data_2kf6_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 2kf6 _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 ' 3' ' ' VAL . . . . . 0.643 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.542 -0.54 . . . . 40.0 109.542 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.581 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.12 146.49 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.648 -0.658 . . . . 40.0 109.463 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -148.67 32.69 0.78 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.114 -0.991 . . . . 40.0 109.305 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.0 p -119.54 141.56 49.12 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.502 -0.879 . . . . 40.0 110.58 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -41.84 -87.37 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 N-CA-C 113.486 0.921 . . . . 40.0 113.486 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.641 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -47.57 -46.16 27.75 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.316 -0.865 . . . . 40.0 109.878 -179.494 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.87 47.95 Favored Glycine 0 N--CA 1.497 2.708 0 N-CA-C 110.043 -1.223 . . . . 40.0 110.043 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.44 -43.88 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.124 -1.221 . . . . 40.0 109.368 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.433 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -57.2 -54.6 44.96 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.557 0.694 . . . . 40.0 109.785 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -49.18 67.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.558 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.1 t80 -51.81 -51.31 57.39 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.952 0.882 . . . . 40.0 109.309 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.536 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 66.0 mt -70.04 -45.77 66.46 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.725 -0.61 . . . . 40.0 111.463 -179.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -62.64 -24.2 67.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.853 -1.154 . . . . 40.0 110.568 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.5 m -101.66 -49.22 4.06 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 120.481 -1.387 . . . . 40.0 111.182 -178.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.585 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.4 m-85 -101.64 -14.05 17.57 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.525 -0.735 . . . . 40.0 110.784 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.536 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.8 m-70 61.78 -25.72 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.096 -1.002 . . . . 40.0 111.788 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.588 ' NZ ' ' OD2' ' A' ' 22' ' ' ASP . 0.4 OUTLIER -73.8 123.76 24.78 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.518 -1.364 . . . . 40.0 109.847 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.65 128.86 13.9 Favored Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.426 -0.796 . . . . 40.0 109.339 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -37.62 131.28 0.72 Allowed 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.411 2.074 . . . . 40.0 112.08 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -63.34 78.4 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.838 0.828 . . . . 40.0 110.11 -179.108 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.643 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 170.26 14.44 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.861 -0.524 . . . . 40.0 110.759 -179.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.432 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.9 m-85 -114.17 164.82 13.36 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.84 0.829 . . . . 40.0 111.834 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.79 150.28 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.345 -0.847 . . . . 40.0 109.695 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.608 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 68.2 p -73.07 150.54 42.23 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.227 -0.92 . . . . 40.0 108.708 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.588 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -48.29 -53.09 18.52 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.802 -1.185 . . . . 40.0 107.802 178.321 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.0 t -46.33 -62.2 1.46 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.445 -0.784 . . . . 40.0 110.714 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.608 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 36.1 mt-10 -50.73 -56.07 13.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.874 -1.141 . . . . 40.0 109.009 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.83 -51.07 59.26 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.264 -0.898 . . . . 40.0 109.768 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.79 -48.35 77.23 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.844 -0.535 . . . . 40.0 110.829 -179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -30.67 69.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.368 -0.833 . . . . 40.0 110.467 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.67 -18.49 64.28 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.17 -0.956 . . . . 40.0 108.759 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.516 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 130.6 -0.7 5.52 Favored Glycine 0 N--CA 1.503 3.157 0 C-N-CA 120.192 -1.004 . . . . 40.0 111.02 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -62.84 113.29 2.96 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.544 -1.563 . . . . 40.0 109.074 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -122.09 141.86 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.344 -0.847 . . . . 40.0 111.032 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.13 -47.32 86.78 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.18 -0.95 . . . . 40.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.5 p -78.52 49.95 0.91 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.735 -1.228 . . . . 40.0 109.258 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -174.27 -49.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.204 -0.665 . . . . 40.0 109.204 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.02 24.42 73.15 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.194 -1.562 . . . . 40.0 109.194 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.516 HD22 ' C ' ' A' ' 34' ' ' GLY . 4.7 p-10 -57.18 130.17 45.0 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.762 -0.846 . . . . 40.0 108.803 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.425 HD22 ' CE2' ' A' ' 78' ' ' TYR . 6.2 tp -169.34 -56.81 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.932 -0.766 . . . . 40.0 108.932 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.46 -27.18 35.69 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.751 -1.218 . . . . 40.0 109.803 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.42 -66.14 0.81 Allowed 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.583 0.706 . . . . 40.0 109.629 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.0 m -69.06 -27.13 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.475 -0.766 . . . . 40.0 110.615 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.469 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -143.82 78.35 14.22 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.936 . . . . 40.0 108.494 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -59.42 54.15 0.07 OUTLIER 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 123.409 2.74 . . . . 40.0 113.644 -178.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.34 40.85 0.07 OUTLIER Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.505 -1.331 . . . . 40.0 110.39 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -120.72 148.66 43.65 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.265 -1.138 . . . . 40.0 110.403 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 4.4 m -120.86 132.0 54.73 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.115 -0.991 . . . . 40.0 110.726 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.46 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 1.7 mm -65.05 155.43 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 CA-C-O 122.55 1.167 . . . . 40.0 111.015 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.495 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.84 154.4 6.4 Favored Glycine 0 N--CA 1.483 1.798 0 N-CA-C 109.15 -1.58 . . . . 40.0 109.15 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 117.44 18.15 5.43 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 119.859 -1.162 . . . . 40.0 111.111 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.54 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -76.58 -170.13 1.44 Allowed 'General case' 0 C--O 1.192 -1.923 0 O-C-N 120.607 -1.525 . . . . 40.0 109.758 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.0 mm -132.84 138.25 52.21 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.024 0 CA-C-O 121.798 0.809 . . . . 40.0 110.257 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -149.92 149.0 29.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.757 -0.589 . . . . 40.0 110.021 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.694 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.59 -17.93 21.86 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.806 -0.559 . . . . 40.0 110.318 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.432 HD22 ' H ' ' A' ' 63' ' ' LEU . 65.9 t30 66.59 27.07 9.68 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.127 -0.983 . . . . 40.0 111.666 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.694 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.0 OUTLIER -55.37 -31.61 61.92 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.2 -1.037 . . . . 40.0 108.2 178.096 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.435 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 21.6 mp0 -64.69 -8.37 14.33 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 108.999 -0.741 . . . . 40.0 108.999 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.15 43.76 98.05 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 110.28 -1.128 . . . . 40.0 110.28 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.569 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -91.8 -13.64 31.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.38 -1.07 . . . . 40.0 109.074 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.432 ' H ' HD22 ' A' ' 58' ' ' ASN . 25.0 mt -135.25 167.43 22.61 Favored Pre-proline 0 N--CA 1.499 1.991 0 N-CA-C 108.299 -1.0 . . . . 40.0 108.299 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.65 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 88.1 Cg_exo -47.21 141.95 12.59 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.595 1.53 . . . . 40.0 112.344 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.649 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.95 -166.9 11.58 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 110.448 -1.061 . . . . 40.0 110.448 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.561 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.8 pttm 172.96 -156.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 106.807 -1.553 . . . . 40.0 106.807 -178.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 57.0 p -75.42 86.44 2.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.656 -1.278 . . . . 40.0 107.901 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.561 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.15 99.19 0.31 Allowed Glycine 0 N--CA 1.498 2.802 0 N-CA-C 108.665 -1.774 . . . . 40.0 108.665 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.649 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 17.0 tpp180 -122.56 140.12 53.14 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.349 -1.089 . . . . 40.0 109.878 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.764 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 31.4 p -107.26 131.32 54.33 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 108.212 -1.033 . . . . 40.0 108.212 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.65 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.3 m95 -126.0 141.57 51.9 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.761 -0.776 . . . . 40.0 110.846 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.61 ' HB2' ' CZ ' ' A' ' 90' ' ' TYR . 0.4 OUTLIER -143.8 148.74 36.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.196 -0.94 . . . . 40.0 109.306 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.588 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -113.71 175.48 5.44 Favored 'General case' 0 C--N 1.31 -1.125 0 O-C-N 120.983 -1.073 . . . . 40.0 113.14 -178.715 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.495 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -161.44 139.29 9.18 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.654 -0.654 . . . . 40.0 110.584 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.632 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.17 154.42 39.81 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.5 -0.75 . . . . 40.0 110.232 -179.562 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.43 HG13 ' HB ' ' A' ' 88' ' ' ILE . 18.3 mm -138.11 152.61 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.174 -0.954 . . . . 40.0 109.381 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.493 HD21 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 56.64 56.29 5.68 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.04 0.447 . . . . 40.0 111.505 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.478 ' CG ' ' N ' ' A' ' 79' ' ' THR . 65.9 t80 -120.51 154.51 35.2 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.936 -1.102 . . . . 40.0 109.129 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.602 ' OG1' ' N ' ' A' ' 80' ' ' SER . 43.5 p -133.32 -79.49 0.48 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 122.036 0.922 . . . . 40.0 109.49 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.602 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.84 103.55 2.78 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 115.314 -0.857 . . . . 40.0 110.027 -179.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.79 -104.58 0.26 Allowed Glycine 0 N--CA 1.501 2.983 0 N-CA-C 108.713 -1.755 . . . . 40.0 108.713 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 15.3 t80 -125.93 -175.46 3.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.534 -0.98 . . . . 40.0 109.429 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.443 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.5 mtm180 -83.68 -149.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.804 . . . . 40.0 109.728 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 38.4 p30 -165.02 -134.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.108 -1.071 . . . . 40.0 108.108 179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 29.9 p -116.0 -9.18 11.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.773 -1.204 . . . . 40.0 109.978 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.493 ' CG ' HD21 ' A' ' 77' ' ' ASN . 23.9 m-20 -74.33 108.77 7.32 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 122.195 -0.316 . . . . 40.0 110.558 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.789 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.07 137.07 42.52 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.114 -0.991 . . . . 40.0 110.422 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.43 ' HB ' HG13 ' A' ' 76' ' ' ILE . 14.6 tt -106.98 146.51 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 CA-C-O 122.108 0.956 . . . . 40.0 110.858 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.411 ' O ' ' HA ' ' A' ' 96' ' ' ILE . 1.8 mm? -124.32 129.78 51.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 40.0 108.808 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.61 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 21.8 p90 -132.65 142.03 48.91 Favored 'General case' 0 N--CA 1.515 2.792 0 N-CA-C 109.528 -0.545 . . . . 40.0 109.528 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.567 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.8 p -108.07 -178.71 3.69 Favored 'General case' 0 N--CA 1.506 2.349 0 CA-C-O 122.248 1.023 . . . . 40.0 113.109 -176.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.764 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.12 -52.66 57.96 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.502 1.144 . . . . 40.0 108.45 178.31 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.554 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -67.67 3.72 1.32 Allowed 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.348 -1.297 . . . . 40.0 110.116 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.498 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 73.2 m95 71.55 15.48 6.07 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.823 -0.548 . . . . 40.0 111.789 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 21.0 mt -69.38 127.39 32.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.26 -1.525 . . . . 40.0 106.916 178.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.459 HG21 HD12 ' A' ' 109' ' ' ILE . 2.5 mp -113.13 135.33 52.98 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 CA-C-O 122.824 1.297 . . . . 40.0 111.347 -177.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.546 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 14.0 m-85 -127.33 159.8 33.3 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.938 -1.504 . . . . 40.0 106.938 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.446 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 4.5 ptmm? -128.45 142.8 50.98 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 119.028 -1.069 . . . . 40.0 112.731 -178.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 131.77 40.84 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 107.616 -1.253 . . . . 40.0 107.616 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.7 p -116.82 9.52 13.92 Favored 'General case' 0 N--CA 1.51 2.551 0 N-CA-C 109.699 -0.482 . . . . 40.0 109.699 -177.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.585 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -114.72 36.2 3.93 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.496 -0.882 . . . . 40.0 109.341 179.196 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.69 69.32 0.69 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.15 -0.968 . . . . 40.0 110.977 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 58.92 45.87 14.54 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.449 -0.782 . . . . 40.0 110.445 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.585 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 31.5 mm-40 -118.82 -78.73 0.59 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.742 -1.224 . . . . 40.0 109.083 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.492 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.0 p -93.84 121.95 35.82 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 120.849 -1.157 . . . . 40.0 110.183 -178.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.569 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -102.91 84.15 2.33 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.571 -0.706 . . . . 40.0 110.881 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.4 m -77.77 142.29 38.75 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.822 -1.174 . . . . 40.0 108.977 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.64 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 60.7 tttp -75.08 144.93 42.71 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.856 -0.528 . . . . 40.0 110.705 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.459 HD12 HG21 ' A' ' 96' ' ' ILE . 26.9 pt -127.49 -28.86 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 109.166 -0.679 . . . . 40.0 109.166 177.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.641 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.066 0 N-CA-C 108.861 -0.792 . . . . 40.0 108.861 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.674 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.0 t . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.347 -0.612 . . . . 40.0 109.347 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.596 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.7 mt -139.01 146.06 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.373 -0.83 . . . . 40.0 109.709 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.9 p-10 -147.52 32.88 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.089 -1.007 . . . . 40.0 109.765 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -118.87 140.94 49.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.949 0.88 . . . . 40.0 110.287 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -41.17 -85.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 113.033 0.753 . . . . 40.0 113.033 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.634 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -48.37 -45.66 35.94 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.744 -0.598 . . . . 40.0 109.851 -178.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.74 -52.11 31.01 Favored Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.495 -1.042 . . . . 40.0 110.495 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 51.3 t -65.77 -45.08 92.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -1.211 . . . . 40.0 109.726 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.453 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -58.06 -56.98 15.03 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.626 0.727 . . . . 40.0 110.168 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.49 -49.58 67.19 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.965 -0.754 . . . . 40.0 108.965 178.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.657 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 16.6 t80 -51.85 -50.85 60.12 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.179 0.99 . . . . 40.0 109.02 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.559 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 29.3 mt -66.37 -47.16 74.29 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 115.918 -0.583 . . . . 40.0 110.713 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -64.13 -21.67 66.64 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.196 -0.94 . . . . 40.0 111.531 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.2 m -105.11 -46.02 4.36 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.875 -1.14 . . . . 40.0 111.811 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.609 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.5 m-85 -100.37 -17.12 17.38 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.145 -0.972 . . . . 40.0 110.919 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.5 m-70 61.97 -29.02 0.07 Allowed 'General case' 0 N--CA 1.505 2.3 0 CA-C-O 121.668 0.746 . . . . 40.0 111.282 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.657 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.47 115.96 12.36 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 120.93 -1.106 . . . . 40.0 108.741 179.503 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.411 ' C ' ' O ' ' A' ' 19' ' ' LYS . 0.9 OUTLIER -42.9 129.92 3.16 Favored Pre-proline 0 N--CA 1.5 2.029 0 N-CA-C 108.846 -0.798 . . . . 40.0 108.846 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.439 ' O ' ' N ' ' A' ' 23' ' ' ASN . 74.2 Cg_exo -35.47 134.82 0.21 Allowed 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.741 2.294 . . . . 40.0 112.94 -179.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.59 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -64.32 73.86 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 121.862 0.839 . . . . 40.0 110.302 -179.011 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.674 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 172.19 16.34 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.606 -0.684 . . . . 40.0 111.367 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -113.57 164.64 13.39 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.311 -0.868 . . . . 40.0 111.034 -178.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -153.91 149.94 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.333 -0.855 . . . . 40.0 109.562 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.546 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 67.2 p -70.6 151.38 45.06 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.671 -0.643 . . . . 40.0 109.509 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.641 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -50.58 -51.76 45.35 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 107.715 -1.217 . . . . 40.0 107.715 177.226 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -47.14 -61.85 1.69 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.614 -0.679 . . . . 40.0 110.473 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.546 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 34.9 mt-10 -49.76 -57.13 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.089 -1.007 . . . . 40.0 108.939 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.93 58.9 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-O 121.632 0.73 . . . . 40.0 109.656 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -64.34 -48.22 76.37 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.829 -0.544 . . . . 40.0 110.985 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.32 -31.08 70.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.259 -0.901 . . . . 40.0 109.957 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.8 -20.11 65.88 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.187 -0.945 . . . . 40.0 108.951 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.534 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 130.99 -1.89 5.5 Favored Glycine 0 N--CA 1.501 2.986 0 N-CA-C 110.863 -0.895 . . . . 40.0 110.863 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -60.07 116.52 4.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.585 -1.538 . . . . 40.0 109.034 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 43.2 t -123.88 143.7 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 CA-C-O 121.735 0.778 . . . . 40.0 110.523 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.8 77.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.244 -0.91 . . . . 40.0 109.812 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.9 p -79.16 51.08 1.13 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.86 -1.15 . . . . 40.0 109.06 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -173.3 -50.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 108.924 -0.769 . . . . 40.0 108.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.39 21.68 72.51 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 108.805 -1.718 . . . . 40.0 108.805 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.534 HD22 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -56.79 132.02 51.04 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.85 -0.794 . . . . 40.0 109.059 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 46' ' ' ALA . 6.1 tp -169.97 -57.2 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.995 -1.113 . . . . 40.0 107.995 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.22 -23.75 49.96 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.683 -0.636 . . . . 40.0 110.768 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.432 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -76.86 -64.41 1.13 Allowed 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.709 -0.849 . . . . 40.0 108.709 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -68.87 -27.05 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . -144.62 79.69 12.22 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.571 -0.705 . . . . 40.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -59.26 55.88 0.06 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.713 2.275 . . . . 40.0 114.105 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.95 43.83 0.06 OUTLIER Glycine 0 N--CA 1.502 3.039 0 C-N-CA 120.104 -1.046 . . . . 40.0 111.152 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -122.89 146.18 47.8 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.771 -1.429 . . . . 40.0 109.585 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.6 m -116.21 136.97 52.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 40.0 109.808 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 7.4 mm -66.49 151.86 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 CA-C-O 121.241 0.543 . . . . 40.0 109.606 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.41 145.72 4.18 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 118.924 -1.607 . . . . 40.0 110.88 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.77 15.86 3.13 Favored Glycine 0 N--CA 1.494 2.56 0 O-C-N 121.305 -1.115 . . . . 40.0 111.388 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.591 ' OD2' ' NZ ' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -72.11 -169.65 0.52 Allowed 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.151 -1.205 . . . . 40.0 110.356 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.1 mm -133.49 138.14 51.61 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.62 0 CA-C-O 121.459 0.647 . . . . 40.0 109.627 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -150.41 146.84 26.93 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.426 -0.796 . . . . 40.0 109.63 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.686 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -91.16 -21.83 20.97 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.691 -0.631 . . . . 40.0 110.174 179.737 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 64.6 t30 72.33 26.69 2.62 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.265 -0.897 . . . . 40.0 111.588 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.686 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.2 mtm-85 -55.32 -31.86 62.01 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.969 -1.082 . . . . 40.0 108.461 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.432 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.2 mp0 -62.9 -10.48 13.58 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.063 -0.717 . . . . 40.0 109.063 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.27 45.42 96.51 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 110.402 -1.079 . . . . 40.0 110.402 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.589 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -95.28 -13.21 25.04 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.579 -0.953 . . . . 40.0 109.741 -179.785 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.493 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 24.7 mt -136.77 163.72 47.56 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.15 -1.056 . . . . 40.0 108.15 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.496 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 91.5 Cg_exo -42.62 141.59 2.31 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 122.449 2.099 . . . . 40.0 112.814 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.468 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.97 -171.02 12.71 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 110.788 -0.925 . . . . 40.0 110.788 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.615 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 ptmm? 177.09 -157.77 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.213 -1.403 . . . . 40.0 107.213 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.1 p -75.08 84.91 2.32 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 107.134 -1.432 . . . . 40.0 107.134 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.615 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.91 99.33 0.35 Allowed Glycine 0 N--CA 1.497 2.726 0 N-CA-C 108.954 -1.658 . . . . 40.0 108.954 -178.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.604 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.1 tpp180 -121.14 142.68 49.64 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.587 -0.949 . . . . 40.0 110.175 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.747 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.99 128.66 55.14 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.341 -0.985 . . . . 40.0 108.341 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.52 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 34.5 m95 -120.54 142.3 49.46 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.062 -1.024 . . . . 40.0 110.814 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.564 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.2 mpp_? -141.22 146.89 37.47 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.462 -0.773 . . . . 40.0 109.986 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.641 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -116.72 169.84 9.05 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 121.184 -0.948 . . . . 40.0 111.983 -179.87 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -157.49 145.31 18.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.561 -0.712 . . . . 40.0 109.747 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.64 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.24 154.63 41.69 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.524 -0.735 . . . . 40.0 109.474 -178.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.423 HG13 ' HB ' ' A' ' 88' ' ' ILE . 15.0 mm -137.34 149.9 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.103 -0.998 . . . . 40.0 109.653 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.45 HD21 ' CG ' ' A' ' 86' ' ' ASP . 76.6 m-20 59.69 57.11 3.32 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.144 0.497 . . . . 40.0 111.016 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.468 ' CG ' ' N ' ' A' ' 79' ' ' THR . 60.6 t80 -121.51 153.83 37.44 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.17 -0.956 . . . . 40.0 109.025 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.0 p -132.29 -79.81 0.5 Allowed 'General case' 0 N--CA 1.5 2.03 0 CA-C-O 121.833 0.825 . . . . 40.0 109.937 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.99 99.92 2.59 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 108.723 -0.843 . . . . 40.0 108.723 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.17 -107.71 0.34 Allowed Glycine 0 N--CA 1.496 2.655 0 N-CA-C 109.953 -1.259 . . . . 40.0 109.953 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.471 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 19.5 t80 -123.43 -178.98 4.16 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.343 -1.093 . . . . 40.0 110.299 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.471 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -83.28 -153.45 0.13 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.744 0.783 . . . . 40.0 110.306 -179.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -162.92 -133.66 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.356 -0.979 . . . . 40.0 108.356 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.9 p -115.39 -10.35 12.01 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.997 -1.064 . . . . 40.0 109.706 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.45 ' CG ' HD21 ' A' ' 77' ' ' ASN . 14.1 m-20 -72.57 108.3 5.54 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 120.834 0.35 . . . . 40.0 110.078 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.757 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.02 137.61 41.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.124 -1.03 . . . . 40.0 110.502 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.444 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.6 tt -107.99 148.01 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 122.509 1.147 . . . . 40.0 110.896 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.444 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -125.48 127.3 46.27 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.704 -0.85 . . . . 40.0 108.704 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.564 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.9 p90 -131.48 141.38 49.76 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.682 -0.858 . . . . 40.0 108.682 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.52 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 61.7 p -107.3 178.73 4.46 Favored 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 122.114 0.959 . . . . 40.0 112.155 -177.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.747 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -50.7 -54.04 26.41 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.37 1.081 . . . . 40.0 108.526 177.381 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.604 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -66.02 3.56 0.82 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.694 -1.139 . . . . 40.0 110.389 -179.153 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.453 ' H ' ' C ' ' A' ' 92' ' ' SER . 64.9 m95 72.44 13.35 5.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.711 -0.618 . . . . 40.0 111.935 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.47 127.16 31.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 119.896 -1.752 . . . . 40.0 107.428 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.453 HD11 ' CB ' ' A' ' 11' ' ' ALA . 2.5 mt -114.24 132.8 62.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-O 122.552 1.168 . . . . 40.0 112.529 -177.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.495 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.4 m-85 -125.26 157.08 37.49 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 114.335 -1.302 . . . . 40.0 107.564 178.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.6 ptmm? -128.03 141.54 51.48 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.027 -1.069 . . . . 40.0 112.36 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 105' ' ' THR . 0.0 OUTLIER -131.1 132.66 44.99 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 107.128 -1.434 . . . . 40.0 107.128 177.248 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.8 p -117.89 9.3 12.83 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 109.449 -0.574 . . . . 40.0 109.449 -178.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.51 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.63 35.11 4.19 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 119.672 -0.811 . . . . 40.0 109.765 179.16 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.13 68.05 0.76 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.21 -0.931 . . . . 40.0 111.036 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 60.53 42.57 14.04 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.793 -0.567 . . . . 40.0 110.778 178.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.51 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.9 mm-40 -114.63 -76.95 0.57 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.732 -1.23 . . . . 40.0 109.655 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.456 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.0 p -93.83 126.03 38.79 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.622 -1.299 . . . . 40.0 110.669 -178.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.589 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.8 m-85 -105.85 85.98 2.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.593 -0.692 . . . . 40.0 110.807 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.5 m -77.89 144.87 36.57 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.25 -0.98 . . . . 40.0 108.793 177.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.682 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 58.8 tttp -77.21 147.92 36.15 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.609 -0.682 . . . . 40.0 110.151 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.451 ' O ' ' HG2' ' A' ' 110' ' ' ARG . 23.2 pt -127.21 -35.46 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 N-CA-C 108.443 -0.947 . . . . 40.0 108.443 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.682 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.11 0 O-C-N 121.565 -0.709 . . . . 40.0 109.576 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.652 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.3 t . . . . . 0 N--CA 1.494 1.765 0 N-CA-C 109.132 -0.692 . . . . 40.0 109.132 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.562 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 9.5 mt -135.78 147.22 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.473 -0.767 . . . . 40.0 109.599 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -147.73 29.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.99 -1.068 . . . . 40.0 109.734 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.4 p -116.48 143.05 46.07 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 119.68 -0.808 . . . . 40.0 110.732 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -42.95 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.372 0 N-CA-C 112.781 0.66 . . . . 40.0 112.781 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.608 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.0 OUTLIER -47.59 -47.23 28.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.583 -0.698 . . . . 40.0 110.135 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.24 -50.91 38.4 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.52 -1.032 . . . . 40.0 110.52 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.2 t -65.58 -46.38 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.097 -1.237 . . . . 40.0 109.426 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.502 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -56.71 -57.1 13.88 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.417 -0.802 . . . . 40.0 110.246 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.08 -51.36 58.13 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 108.904 -0.776 . . . . 40.0 108.904 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.644 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.0 t80 -51.12 -49.93 59.82 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.969 0.89 . . . . 40.0 109.781 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.607 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 34.7 mt -68.25 -45.5 73.03 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.623 -0.673 . . . . 40.0 110.118 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -65.27 -19.12 65.82 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.387 -0.925 . . . . 40.0 111.744 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.9 m -107.52 -44.01 4.39 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.766 -1.209 . . . . 40.0 110.821 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.595 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.9 m-85 -104.52 -14.44 15.67 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 40.0 111.615 -177.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.607 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.3 m-70 59.54 -33.44 0.06 Allowed 'General case' 0 N--CA 1.51 2.549 0 CA-C-O 121.288 0.566 . . . . 40.0 111.483 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.644 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -68.68 120.85 15.32 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.758 -1.214 . . . . 40.0 108.233 179.481 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.474 ' HA ' HD23 ' A' ' 14' ' ' LEU . 3.4 mt -48.13 133.02 12.34 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.335 -0.853 . . . . 40.0 109.398 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.458 ' O ' ' N ' ' A' ' 23' ' ' ASN . 78.7 Cg_exo -35.82 132.36 0.29 Allowed 'Trans proline' 0 C--N 1.313 -1.341 0 C-N-CA 122.732 2.288 . . . . 40.0 112.889 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.557 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.3 OUTLIER -63.48 74.8 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.955 0.883 . . . . 40.0 109.732 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.652 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 172.42 15.68 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.655 -0.653 . . . . 40.0 110.577 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -114.93 162.94 16.26 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.747 0.784 . . . . 40.0 111.095 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -149.38 151.4 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.086 -1.009 . . . . 40.0 109.698 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.605 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 77.7 p -71.57 149.64 45.48 Favored 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 109.049 -0.723 . . . . 40.0 109.049 177.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.65 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -48.77 -53.67 18.14 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.196 -1.039 . . . . 40.0 108.196 177.812 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.2 t -45.58 -63.19 1.01 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.739 -0.6 . . . . 40.0 110.415 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.605 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 44.5 mt-10 -49.42 -57.12 7.52 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.54 -0.725 . . . . 40.0 109.357 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.01 -48.49 70.38 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.324 -0.86 . . . . 40.0 109.91 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.408 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 57.0 mt-30 -64.43 -48.74 74.18 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 40.0 110.192 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.18 70.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 40.0 110.46 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.68 -20.35 66.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.288 -0.883 . . . . 40.0 109.209 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.521 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 132.73 -4.04 5.04 Favored Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.942 -1.123 . . . . 40.0 111.106 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -61.2 114.39 3.12 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.709 -1.465 . . . . 40.0 109.098 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.7 t -121.93 143.0 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-O 121.799 0.809 . . . . 40.0 110.626 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.08 -47.58 84.03 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.642 -0.661 . . . . 40.0 110.243 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.2 p -79.13 50.15 1.02 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.064 -1.022 . . . . 40.0 108.997 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -174.25 -51.55 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.115 -0.698 . . . . 40.0 109.115 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.63 23.76 75.4 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.521 HD22 ' C ' ' A' ' 34' ' ' GLY . 4.1 p-10 -56.51 130.11 43.64 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.838 -0.801 . . . . 40.0 108.967 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 46' ' ' ALA . 5.4 tp -168.26 -60.05 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.997 -0.742 . . . . 40.0 108.997 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.32 -23.64 38.44 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.312 -0.868 . . . . 40.0 109.808 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -65.06 0.98 Allowed 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.916 -0.772 . . . . 40.0 108.916 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.49 -26.76 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-O 121.468 0.652 . . . . 40.0 109.553 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -144.65 78.64 12.88 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.32 -0.862 . . . . 40.0 109.873 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -57.49 52.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.497 1.728 0 C-N-CA 122.847 2.364 . . . . 40.0 114.238 -178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.34 42.92 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 C-N-CA 119.565 -1.302 . . . . 40.0 111.262 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -121.71 144.5 48.75 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.26 . . . . 40.0 109.996 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.0 m -116.25 132.18 56.74 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.177 -0.952 . . . . 40.0 109.941 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.8 mm -63.89 150.86 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.342 -0.849 . . . . 40.0 110.099 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.77 151.61 5.73 Favored Glycine 0 N--CA 1.502 3.048 0 C-N-CA 119.798 -1.191 . . . . 40.0 110.472 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 118.82 18.2 4.83 Favored Glycine 0 N--CA 1.497 2.709 0 O-C-N 121.177 -1.19 . . . . 40.0 110.865 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.65 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -75.78 -169.93 1.2 Allowed 'General case' 0 C--O 1.191 -1.987 0 O-C-N 121.182 -1.187 . . . . 40.0 109.537 179.768 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.8 mm -133.81 142.1 42.29 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.906 0 CA-C-O 121.726 0.774 . . . . 40.0 109.945 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -154.51 146.85 23.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.696 -0.627 . . . . 40.0 109.53 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.685 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -93.39 -19.38 21.37 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.431 -0.793 . . . . 40.0 110.874 -179.762 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.505 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.8 t30 69.15 30.14 4.45 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.115 -0.99 . . . . 40.0 111.825 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.685 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.86 -31.69 65.07 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.966 -1.084 . . . . 40.0 108.43 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.456 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.0 mp0 -63.47 -11.54 24.51 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 63.24 41.23 99.64 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.153 -1.179 . . . . 40.0 110.153 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.589 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -91.6 -13.81 31.3 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.446 -1.032 . . . . 40.0 109.157 179.706 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.505 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 30.8 mt -135.72 163.37 51.01 Favored Pre-proline 0 N--CA 1.494 1.762 0 N-CA-C 108.579 -0.897 . . . . 40.0 108.579 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.65 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 85.4 Cg_exo -43.21 140.11 3.72 Favored 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 121.915 1.744 . . . . 40.0 112.239 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.619 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.16 -165.8 11.4 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.819 -1.312 . . . . 40.0 109.819 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.578 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 pttm 171.45 -154.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 107.6 -1.259 . . . . 40.0 107.6 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.4 ' N ' ' HG3' ' A' ' 66' ' ' LYS . 17.6 p -74.57 81.91 2.0 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.245 -1.391 . . . . 40.0 107.245 176.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.578 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.85 105.19 0.21 Allowed Glycine 0 N--CA 1.499 2.872 0 N-CA-C 108.762 -1.735 . . . . 40.0 108.762 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.62 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -126.53 141.52 51.84 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.654 -0.909 . . . . 40.0 110.155 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.795 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 27.8 p -108.71 130.13 55.36 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.955 -0.757 . . . . 40.0 108.955 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.65 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 33.5 m95 -121.78 146.24 47.25 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 119.522 -0.871 . . . . 40.0 110.895 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.8 OUTLIER -147.13 140.77 25.65 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.095 -1.003 . . . . 40.0 109.314 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.604 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -111.85 164.59 12.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.0 -1.062 . . . . 40.0 111.17 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -151.41 147.12 26.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.693 -0.63 . . . . 40.0 109.62 178.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.633 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.51 155.8 40.23 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.097 -1.002 . . . . 40.0 110.583 -178.503 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.0 mm -139.19 151.81 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.255 -0.903 . . . . 40.0 110.147 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.541 HD21 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 57.96 53.88 6.49 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.311 0.577 . . . . 40.0 111.096 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.463 ' CG ' ' N ' ' A' ' 79' ' ' THR . 61.5 t80 -118.32 153.78 33.41 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.314 -0.866 . . . . 40.0 108.997 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.563 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.9 p -132.8 -79.09 0.49 Allowed 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.739 0.781 . . . . 40.0 109.765 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.563 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.26 101.83 2.72 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 109.387 -0.597 . . . . 40.0 109.387 -178.918 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -104.99 0.27 Allowed Glycine 0 N--CA 1.5 2.913 0 N-CA-C 109.643 -1.383 . . . . 40.0 109.643 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.478 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 23.1 t80 -125.85 -178.0 4.13 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.522 -0.987 . . . . 40.0 109.882 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 3.0 mtm180 -83.55 -152.02 0.12 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.43 -0.793 . . . . 40.0 110.456 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 38.4 p-10 -164.01 -132.58 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.686 -0.857 . . . . 40.0 108.686 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.4 p -116.48 -9.63 11.4 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.199 -0.938 . . . . 40.0 109.575 -178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.541 ' CG ' HD21 ' A' ' 77' ' ' ASN . 12.6 m-20 -75.01 108.99 8.1 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-N 116.4 -0.364 . . . . 40.0 110.758 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.78 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.57 140.14 44.42 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.232 -0.917 . . . . 40.0 110.395 179.393 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 11.8 tt -108.57 148.98 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-O 122.533 1.159 . . . . 40.0 110.341 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -126.94 124.65 39.99 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.431 -0.951 . . . . 40.0 108.431 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.522 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.3 p90 -128.36 141.38 51.44 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 108.968 -0.753 . . . . 40.0 108.968 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.558 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 59.4 p -107.51 -178.4 3.62 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.083 -1.01 . . . . 40.0 112.017 -176.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.795 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.58 -55.81 22.54 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.403 1.097 . . . . 40.0 108.34 177.464 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.62 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -64.63 5.28 0.31 Allowed 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 114.419 -1.264 . . . . 40.0 110.388 -179.187 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.486 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 66.3 m95 70.46 14.65 7.36 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.74 -0.6 . . . . 40.0 111.856 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.42 127.89 34.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 119.66 -1.9 . . . . 40.0 106.719 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.502 HD11 ' CB ' ' A' ' 11' ' ' ALA . 3.0 mt -115.96 134.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 CA-C-O 122.803 1.287 . . . . 40.0 111.602 -177.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 13.9 m-85 -126.91 157.22 39.98 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.269 -1.382 . . . . 40.0 107.269 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.429 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.3 144.75 50.99 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 118.929 -1.108 . . . . 40.0 112.39 -178.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.17 132.68 38.28 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.772 -1.195 . . . . 40.0 107.772 177.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.2 p -117.87 9.2 12.82 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-O 120.91 0.386 . . . . 40.0 109.973 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.573 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.99 33.18 5.38 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.768 -0.773 . . . . 40.0 109.973 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 63.17 70.13 0.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.975 -1.078 . . . . 40.0 110.362 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 56.49 48.33 16.99 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.52 -0.737 . . . . 40.0 109.835 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.573 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 27.3 mm-40 -120.0 -77.71 0.58 Allowed 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.724 -1.235 . . . . 40.0 109.339 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.518 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 17.7 p -94.78 120.58 35.23 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.724 -1.235 . . . . 40.0 110.155 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.527 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -102.28 86.4 2.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.417 -0.802 . . . . 40.0 110.545 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.4 m -79.13 146.9 32.92 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.199 -0.938 . . . . 40.0 109.036 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.594 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 58.0 tttp -78.04 146.87 35.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.796 -0.565 . . . . 40.0 110.41 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.479 HG13 ' N ' ' A' ' 110' ' ' ARG . 22.4 pt -128.98 -32.0 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 N-CA-C 109.126 -0.694 . . . . 40.0 109.126 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.608 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 108.493 -0.929 . . . . 40.0 108.493 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.68 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.6 t . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.647 -0.501 . . . . 40.0 109.647 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.523 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -137.88 148.93 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.243 -0.911 . . . . 40.0 109.065 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -149.05 34.03 0.74 Allowed 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.209 -0.932 . . . . 40.0 109.798 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 24.4 p -120.09 142.91 48.45 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 119.635 -0.826 . . . . 40.0 110.56 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -43.28 -84.98 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 CA-C-O 121.952 0.882 . . . . 40.0 112.573 -179.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.615 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.6 OUTLIER -45.82 -47.56 15.8 Favored 'General case' 0 C--N 1.283 -2.298 0 O-C-N 121.853 -0.529 . . . . 40.0 110.035 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.62 -49.92 50.96 Favored Glycine 0 N--CA 1.502 3.048 0 N-CA-C 110.331 -1.108 . . . . 40.0 110.331 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -66.17 -43.97 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.224 -1.162 . . . . 40.0 108.562 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.412 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -56.86 -58.33 8.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.252 -0.905 . . . . 40.0 109.388 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.05 -49.38 63.58 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.368 0.604 . . . . 40.0 109.605 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.609 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.6 t80 -53.67 -48.96 68.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.011 0.91 . . . . 40.0 109.65 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.54 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 29.9 mt -69.63 -46.12 66.93 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.805 -0.559 . . . . 40.0 110.658 -178.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -64.72 -22.11 66.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.429 -0.794 . . . . 40.0 110.875 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 m -103.25 -43.89 5.33 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.643 -1.286 . . . . 40.0 111.851 -178.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.583 ' C ' ' H ' ' A' ' 19' ' ' LYS . 86.2 m-85 -107.51 -12.6 15.26 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.168 -0.957 . . . . 40.0 111.005 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.54 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 60.56 -30.9 0.06 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.975 -0.453 . . . . 40.0 111.817 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.609 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -69.69 117.48 11.34 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.936 -1.103 . . . . 40.0 108.583 179.254 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mt -44.92 131.75 5.26 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.476 -0.765 . . . . 40.0 109.151 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.451 ' O ' ' N ' ' A' ' 23' ' ' ASN . 71.3 Cg_exo -34.59 132.72 0.17 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.782 2.321 . . . . 40.0 112.549 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.561 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -63.49 74.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.59 0.709 . . . . 40.0 110.479 -179.313 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.68 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 172.37 18.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.578 -0.701 . . . . 40.0 110.681 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -116.57 160.96 19.9 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.52 -0.738 . . . . 40.0 110.978 -178.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.52 152.58 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.249 -0.907 . . . . 40.0 109.151 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.572 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 72.9 p -71.5 151.01 44.3 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.367 0.603 . . . . 40.0 110.093 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -50.67 -51.75 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.74 -1.207 . . . . 40.0 107.74 177.251 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.9 t -47.13 -62.13 1.56 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.282 -0.886 . . . . 40.0 110.232 178.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.572 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 37.3 mt-10 -48.53 -58.67 4.33 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.288 -0.883 . . . . 40.0 109.162 178.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.26 -49.42 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 121.562 0.696 . . . . 40.0 110.067 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -65.07 -50.09 67.49 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.371 0.605 . . . . 40.0 110.32 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.1 -30.36 70.36 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.434 -0.791 . . . . 40.0 110.16 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.9 mt -68.22 -19.69 64.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 40.0 109.215 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.507 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 131.85 -2.19 5.18 Favored Glycine 0 N--CA 1.5 2.922 0 C-N-CA 119.847 -1.168 . . . . 40.0 111.221 178.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -62.56 113.79 3.17 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.697 -1.472 . . . . 40.0 109.047 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -121.69 144.91 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 40.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.79 85.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.442 -0.786 . . . . 40.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.2 p -79.18 52.17 1.27 Allowed 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.266 -1.013 . . . . 40.0 108.266 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -174.83 -52.26 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 109.261 -0.644 . . . . 40.0 109.261 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.65 22.94 76.88 Favored Glycine 0 N--CA 1.5 2.954 0 N-CA-C 109.38 -1.488 . . . . 40.0 109.38 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.507 HD22 ' C ' ' A' ' 34' ' ' GLY . 4.0 p-10 -59.78 126.51 27.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.58 -0.953 . . . . 40.0 110.304 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.445 ' O ' ' N ' ' A' ' 46' ' ' ALA . 0.9 OUTLIER -165.53 -57.59 0.03 OUTLIER 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.552 -0.907 . . . . 40.0 108.552 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.422 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . . . -53.93 -29.14 41.04 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.264 -0.897 . . . . 40.0 109.865 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -63.0 1.37 Allowed 'General case' 0 N--CA 1.504 2.228 0 CA-C-O 121.553 0.692 . . . . 40.0 109.732 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.6 m -71.1 -23.76 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.409 -0.807 . . . . 40.0 110.403 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.493 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -148.78 76.38 9.75 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.153 -0.967 . . . . 40.0 109.461 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.422 ' HA ' ' HA ' ' A' ' 43' ' ' ALA . 2.8 Cg_exo -61.82 57.28 0.12 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.213 1.942 . . . . 40.0 113.097 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 146.62 36.18 0.06 OUTLIER Glycine 0 N--CA 1.504 3.179 0 N-CA-C 110.71 -0.956 . . . . 40.0 110.71 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.442 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 9.4 tttt -118.48 144.14 46.22 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.724 -1.457 . . . . 40.0 109.995 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.8 m -117.02 134.36 54.85 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.217 -0.927 . . . . 40.0 109.314 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 8.7 mm -65.01 148.41 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 CA-C-O 121.675 0.75 . . . . 40.0 109.719 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.81 145.34 4.12 Favored Glycine 0 N--CA 1.494 2.529 0 C-N-CA 119.002 -1.57 . . . . 40.0 111.151 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.14 17.52 3.0 Favored Glycine 0 N--CA 1.494 2.564 0 C-N-CA 119.986 -1.102 . . . . 40.0 111.11 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.644 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -73.33 -166.58 0.34 Allowed 'General case' 0 C--O 1.196 -1.713 0 O-C-N 120.844 -1.386 . . . . 40.0 109.908 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -134.72 140.48 45.5 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.688 0 CA-C-O 121.555 0.693 . . . . 40.0 109.826 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -152.26 146.35 25.35 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.542 -0.724 . . . . 40.0 109.727 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.679 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.23 -18.37 21.75 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.497 -0.752 . . . . 40.0 110.529 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.482 HD22 ' H ' ' A' ' 63' ' ' LEU . 63.3 t30 69.3 29.04 4.67 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.113 -0.992 . . . . 40.0 111.633 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.679 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.45 -30.83 63.35 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.039 -1.038 . . . . 40.0 108.213 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 24.5 mp0 -64.75 -10.3 26.6 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.369 -0.604 . . . . 40.0 109.369 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.29 44.89 97.03 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.031 -1.228 . . . . 40.0 110.031 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.582 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -94.95 -13.16 25.6 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.603 -0.939 . . . . 40.0 109.249 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.482 ' H ' HD22 ' A' ' 58' ' ' ASN . 24.3 mt -135.18 164.05 46.63 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 108.378 -0.971 . . . . 40.0 108.378 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.565 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 94.8 Cg_exo -44.08 138.13 6.82 Favored 'Trans proline' 0 N--CA 1.495 1.595 0 C-N-CA 121.83 1.687 . . . . 40.0 112.006 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.608 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.15 -167.4 11.94 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 110.205 -1.158 . . . . 40.0 110.205 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.526 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.2 pttm 173.7 -158.67 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.15 -1.426 . . . . 40.0 107.15 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.6 p -73.6 92.29 1.93 Allowed 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.371 -1.344 . . . . 40.0 107.371 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.526 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.1 98.99 0.11 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.116 -1.593 . . . . 40.0 109.116 -178.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.608 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.9 tpp180 -124.49 138.79 54.31 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.7 -0.882 . . . . 40.0 109.587 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.732 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 22.4 p -106.79 130.64 54.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.5 -0.926 . . . . 40.0 108.5 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.565 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 30.6 m95 -122.43 145.49 48.24 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.379 -0.826 . . . . 40.0 110.545 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.531 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.0 OUTLIER -142.95 145.36 32.93 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.289 -0.882 . . . . 40.0 109.583 -179.236 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -114.8 166.44 11.76 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.09 -1.006 . . . . 40.0 111.557 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -156.02 143.6 19.42 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.275 -0.891 . . . . 40.0 110.371 178.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.653 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.3 OUTLIER -66.87 153.38 43.62 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.313 -0.867 . . . . 40.0 111.188 -178.79 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.427 HG13 ' HB ' ' A' ' 88' ' ' ILE . 18.7 mm -136.98 153.5 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.393 -0.817 . . . . 40.0 109.799 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.481 HD21 ' CG ' ' A' ' 86' ' ' ASP . 74.8 m-20 56.44 51.62 11.13 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.064 0.459 . . . . 40.0 111.872 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.475 ' CG ' ' N ' ' A' ' 79' ' ' THR . 59.3 t80 -117.39 154.01 32.06 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.126 -0.983 . . . . 40.0 109.323 178.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.615 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.4 p -131.97 -79.61 0.51 Allowed 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.058 0.932 . . . . 40.0 109.424 178.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.615 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -150.89 106.0 3.33 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.773 -0.825 . . . . 40.0 108.773 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 150.76 -107.79 0.36 Allowed Glycine 0 N--CA 1.499 2.883 0 N-CA-C 109.803 -1.319 . . . . 40.0 109.803 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.444 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.7 t80 -125.08 -177.97 4.03 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.345 -1.091 . . . . 40.0 109.376 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.444 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -82.6 -151.74 0.1 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.418 -0.801 . . . . 40.0 110.37 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.4 HD22 ' HB2' ' A' ' 77' ' ' ASN . 36.8 p30 -163.92 -134.21 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.253 -1.017 . . . . 40.0 108.253 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 53.3 p -116.02 -9.05 11.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.891 -1.131 . . . . 40.0 109.621 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.481 ' CG ' HD21 ' A' ' 77' ' ' ASN . 19.7 m-20 -74.45 109.53 8.01 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 120.798 0.333 . . . . 40.0 110.414 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.769 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.45 139.9 44.45 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 119.521 -0.872 . . . . 40.0 109.951 179.31 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.427 ' HB ' HG13 ' A' ' 76' ' ' ILE . 18.9 tt -108.79 149.1 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-O 122.403 1.096 . . . . 40.0 110.117 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -125.74 127.21 45.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.355 -0.841 . . . . 40.0 109.026 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.531 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.0 p90 -129.93 140.65 50.9 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.492 -0.558 . . . . 40.0 109.492 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.555 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.5 p -105.4 -178.07 3.55 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-O 122.27 1.033 . . . . 40.0 112.73 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.732 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -56.2 -50.54 70.95 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-O 122.205 1.003 . . . . 40.0 108.645 178.039 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.542 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -70.25 4.95 1.91 Allowed 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 114.656 -1.157 . . . . 40.0 110.234 -178.85 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.451 ' HB2' ' O ' ' A' ' 93' ' ' ASP . 69.7 m95 72.21 17.4 4.99 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.848 -0.532 . . . . 40.0 111.474 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.8 mt -72.04 125.83 28.24 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.901 -1.518 . . . . 40.0 106.901 177.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.412 HD11 ' CB ' ' A' ' 11' ' ' ALA . 2.4 mp -112.97 133.54 58.48 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 CA-C-O 122.798 1.285 . . . . 40.0 111.975 -177.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.586 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 13.3 m-85 -126.14 158.52 35.31 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.402 -1.333 . . . . 40.0 107.402 178.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -126.79 143.75 51.16 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.642 -1.223 . . . . 40.0 112.462 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.415 HG22 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.9 129.62 36.63 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.521 -1.289 . . . . 40.0 107.521 177.494 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.7 p -115.6 9.47 15.34 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 109.718 -0.475 . . . . 40.0 109.718 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.567 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.1 35.18 4.45 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 119.799 -0.76 . . . . 40.0 109.36 179.183 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.2 68.76 0.74 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.383 -0.823 . . . . 40.0 111.168 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 62.07 40.37 12.12 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.47 -0.769 . . . . 40.0 110.657 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.567 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.2 mm-40 -114.39 -76.14 0.58 Allowed 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.749 -1.219 . . . . 40.0 110.002 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.522 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 27.5 p -95.13 124.0 38.93 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.706 -1.246 . . . . 40.0 110.068 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.551 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -104.44 84.71 2.23 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.475 -0.765 . . . . 40.0 110.891 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.35 145.42 35.26 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.954 -1.091 . . . . 40.0 108.948 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.639 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 59.1 tttp -76.84 143.72 39.54 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.972 -0.455 . . . . 40.0 110.193 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 36.8 pt -127.45 -31.4 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 109.446 -0.576 . . . . 40.0 109.446 178.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.639 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 1.4 mmt-85 . . . . . 0 N--CA 1.504 2.241 0 N-CA-C 109.157 -0.683 . . . . 40.0 109.157 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.701 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.1 t . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 121.003 0.43 . . . . 40.0 109.983 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.58 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.0 mt -138.02 148.62 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.288 -0.883 . . . . 40.0 109.824 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -149.24 32.62 0.74 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.265 -0.897 . . . . 40.0 109.515 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 37.9 p -118.65 139.23 51.85 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.782 0.801 . . . . 40.0 110.314 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -40.62 -87.95 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 122.291 1.043 . . . . 40.0 113.367 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.642 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.5 OUTLIER -44.13 -48.78 9.13 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 115.734 -0.666 . . . . 40.0 109.877 -179.042 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.48 -50.49 41.54 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 110.298 -1.121 . . . . 40.0 110.298 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.7 t -65.42 -46.32 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.019 -1.283 . . . . 40.0 109.099 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.17 -57.89 9.9 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.573 0.701 . . . . 40.0 110.119 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.21 -49.72 63.34 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.681 -0.637 . . . . 40.0 109.672 178.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.638 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 18.5 t80 -51.65 -50.17 60.87 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.312 1.053 . . . . 40.0 108.605 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.58 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 25.6 mt -69.28 -45.12 70.41 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.592 -0.731 . . . . 40.0 111.006 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -65.08 -21.61 66.84 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 40.0 110.926 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.9 m -103.09 -44.7 5.14 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.015 -1.053 . . . . 40.0 111.56 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.595 ' C ' ' H ' ' A' ' 19' ' ' LYS . 88.9 m-85 -105.53 -13.63 15.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.129 -0.982 . . . . 40.0 111.42 -177.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.58 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 59.77 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 121.303 0.573 . . . . 40.0 111.759 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.638 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.65 117.92 14.93 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 120.494 -1.379 . . . . 40.0 108.886 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -45.84 128.44 6.89 Favored Pre-proline 0 C--N 1.296 -1.74 0 O-C-N 121.328 -0.858 . . . . 40.0 109.461 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' CE2' ' A' ' 13' ' ' TYR . 75.1 Cg_exo -34.11 133.31 0.14 Allowed 'Trans proline' 0 N--CA 1.489 1.251 0 C-N-CA 122.976 2.451 . . . . 40.0 112.988 -179.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.575 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -64.78 75.75 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.806 0.812 . . . . 40.0 110.791 -178.827 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.701 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 171.83 16.05 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.862 -0.523 . . . . 40.0 110.919 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -113.06 167.42 10.54 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.432 -0.793 . . . . 40.0 111.353 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -158.16 150.89 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.067 -1.021 . . . . 40.0 108.801 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.511 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 82.3 p -69.7 154.23 42.27 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.384 0.611 . . . . 40.0 109.548 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.659 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -53.29 -50.72 64.3 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.148 -1.427 . . . . 40.0 107.148 176.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -47.65 -62.13 1.6 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.51 -0.744 . . . . 40.0 110.544 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.511 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 40.1 mt-10 -49.05 -57.61 6.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.347 -0.845 . . . . 40.0 109.172 178.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.9 -49.99 61.92 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.581 -0.699 . . . . 40.0 109.71 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.406 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 51.4 mt-30 -64.05 -50.07 69.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.689 -0.632 . . . . 40.0 110.762 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.89 -32.79 74.28 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.429 -0.794 . . . . 40.0 109.953 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mt -64.89 -20.68 66.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.268 -0.895 . . . . 40.0 109.334 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.517 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 131.49 -2.02 5.31 Favored Glycine 0 N--CA 1.498 2.767 0 N-CA-C 110.668 -0.973 . . . . 40.0 110.668 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -59.97 114.01 2.6 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.73 -1.453 . . . . 40.0 109.299 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.27 143.44 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 CA-C-O 121.926 0.869 . . . . 40.0 111.168 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.3 78.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.797 -0.564 . . . . 40.0 110.392 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.5 p -79.32 52.08 1.3 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.016 -1.053 . . . . 40.0 108.452 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -175.49 -52.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.095 -0.706 . . . . 40.0 109.095 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.22 18.14 76.43 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.517 HD22 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -52.96 130.35 33.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.943 -0.739 . . . . 40.0 109.905 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 46' ' ' ALA . 3.7 tp -169.34 -57.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.517 -0.92 . . . . 40.0 108.517 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.68 -25.36 53.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.231 -0.918 . . . . 40.0 109.934 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -77.87 -60.05 2.53 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.122 -0.695 . . . . 40.0 109.122 -179.794 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.2 m -74.27 -22.46 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.527 -0.733 . . . . 40.0 109.64 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.548 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . -148.77 78.78 8.88 Favored Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 40.0 109.339 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -56.24 50.55 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 123.311 2.674 . . . . 40.0 113.998 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.547 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.17 0.06 OUTLIER Glycine 0 N--CA 1.504 3.175 0 C-N-CA 119.911 -1.138 . . . . 40.0 111.047 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.469 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 18.6 tttt -120.14 145.59 46.79 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 120.906 -1.349 . . . . 40.0 109.662 179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.8 m -116.61 136.3 53.09 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.306 -0.871 . . . . 40.0 109.642 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.5 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.9 mm -69.63 153.79 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.866 . . . . 40.0 110.223 -179.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.77 143.98 3.83 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 119.048 -1.548 . . . . 40.0 110.401 179.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 128.88 13.2 2.5 Favored Glycine 0 N--CA 1.496 2.636 0 C-N-CA 119.495 -1.336 . . . . 40.0 111.217 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.659 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -73.99 -172.83 1.43 Allowed 'General case' 0 C--O 1.195 -1.804 0 O-C-N 120.904 -1.35 . . . . 40.0 110.84 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.48 143.74 40.06 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 CA-C-O 121.701 0.762 . . . . 40.0 110.173 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -155.94 147.2 22.53 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.31 -0.868 . . . . 40.0 109.54 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.65 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.19 -16.6 24.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.739 -0.601 . . . . 40.0 110.636 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.9 t30 66.19 28.09 10.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.17 -0.956 . . . . 40.0 111.72 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.655 ' HB2' ' CZ ' ' A' ' 59' ' ' ARG . 1.1 mtm-85 -56.45 -31.06 63.62 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.023 -1.048 . . . . 40.0 108.384 178.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.488 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 17.4 mp0 -61.93 -12.1 16.46 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.903 -0.777 . . . . 40.0 108.903 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.55 40.44 99.13 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 110.003 -1.239 . . . . 40.0 110.003 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.554 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -93.99 -10.51 33.37 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.828 -0.807 . . . . 40.0 109.23 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.521 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 36.9 mt -135.62 162.64 55.92 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 108.032 -1.099 . . . . 40.0 108.032 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.663 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 97.3 Cg_exo -44.79 139.52 7.54 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 121.536 1.491 . . . . 40.0 112.298 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.497 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.94 -169.58 12.49 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 110.361 -1.096 . . . . 40.0 110.361 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.471 ' HB3' ' NH2' ' A' ' 69' ' ' ARG . 3.4 pttm 175.35 -156.66 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.924 -1.51 . . . . 40.0 106.924 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -74.41 84.54 1.97 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.546 -1.279 . . . . 40.0 107.546 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.442 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.42 102.82 0.2 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 108.417 -1.873 . . . . 40.0 108.417 -178.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.564 HH11 ' CG ' ' A' ' 93' ' ' ASP . 15.6 tpp180 -125.51 141.55 51.98 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.869 -0.783 . . . . 40.0 109.55 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.741 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 25.5 p -108.88 131.31 55.13 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.741 -0.837 . . . . 40.0 108.741 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.663 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.2 m95 -121.91 147.97 45.34 Favored 'General case' 0 N--CA 1.5 2.047 0 C-N-CA 119.453 -0.899 . . . . 40.0 111.014 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.565 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.3 mpp_? -146.02 144.72 30.26 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.183 -0.948 . . . . 40.0 109.676 -178.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.643 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.09 165.55 13.01 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.146 -0.971 . . . . 40.0 111.515 179.558 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -152.16 147.5 26.5 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.504 -0.748 . . . . 40.0 109.574 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.679 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -71.38 150.77 44.71 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.592 -0.693 . . . . 40.0 110.244 -179.061 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.462 HG13 ' HB ' ' A' ' 88' ' ' ILE . 15.5 mm -134.66 150.59 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 40.0 109.916 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.509 HD21 ' CG ' ' A' ' 86' ' ' ASP . 76.7 m-20 58.26 60.15 2.76 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-O 121.235 0.541 . . . . 40.0 111.485 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.475 ' CG ' ' N ' ' A' ' 79' ' ' THR . 66.2 t80 -123.87 154.28 39.89 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.103 -0.998 . . . . 40.0 109.385 178.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.588 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.0 p -132.19 -80.38 0.5 Allowed 'General case' 0 N--CA 1.502 2.154 0 CA-C-O 121.719 0.771 . . . . 40.0 110.005 179.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.588 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.16 102.01 2.75 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 109.167 -0.679 . . . . 40.0 109.167 -179.107 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.88 -104.32 0.26 Allowed Glycine 0 N--CA 1.5 2.965 0 N-CA-C 109.833 -1.307 . . . . 40.0 109.833 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.451 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.8 t80 -125.79 -178.42 4.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.47 -1.018 . . . . 40.0 109.934 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.456 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.7 mtm180 -83.86 -151.88 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.655 -0.653 . . . . 40.0 110.425 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.466 HD22 ' HB2' ' A' ' 86' ' ' ASP . 47.7 p-10 -164.7 -136.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.851 -0.796 . . . . 40.0 108.851 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 p -113.13 -11.85 13.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.993 -1.067 . . . . 40.0 109.871 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.509 ' CG ' HD21 ' A' ' 77' ' ' ASN . 11.8 m-20 -71.79 109.17 5.49 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 120.964 0.412 . . . . 40.0 110.518 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.789 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.85 140.55 44.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.533 -0.729 . . . . 40.0 110.025 179.657 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.488 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.9 tt -111.23 149.93 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 CA-C-O 122.375 1.084 . . . . 40.0 109.757 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -127.18 127.54 44.67 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 109.326 -0.62 . . . . 40.0 109.326 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.565 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.6 p90 -131.65 141.76 49.69 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 109.116 -0.698 . . . . 40.0 109.116 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.511 ' HB3' ' CE2' ' A' ' 71' ' ' TRP . 64.3 p -107.61 -179.86 4.03 Favored 'General case' 0 N--CA 1.505 2.287 0 CA-C-O 122.22 1.01 . . . . 40.0 112.418 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.741 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.77 -50.54 63.34 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 122.35 1.072 . . . . 40.0 108.636 178.508 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.564 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 3.83 1.84 Allowed 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.598 -1.183 . . . . 40.0 110.241 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.463 ' HB2' ' O ' ' A' ' 93' ' ' ASP . 78.5 m95 72.53 13.59 5.36 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.764 -0.585 . . . . 40.0 111.758 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 21.1 mt -70.01 128.9 37.94 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.819 -1.8 . . . . 40.0 107.562 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.429 ' HA ' ' O ' ' A' ' 89' ' ' LEU . 2.5 mt -114.59 135.54 54.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 CA-C-O 122.707 1.241 . . . . 40.0 112.527 -176.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.569 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.8 m-85 -127.75 156.49 42.35 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.377 -1.342 . . . . 40.0 107.377 179.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 4.7 ptmm? -125.31 143.64 50.87 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 118.758 -1.177 . . . . 40.0 112.73 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.84 132.09 38.19 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.233 -1.395 . . . . 40.0 107.233 177.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.0 p -117.9 11.56 13.51 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 109.566 -0.531 . . . . 40.0 109.566 -177.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.579 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -116.32 32.97 5.8 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.902 -0.719 . . . . 40.0 109.798 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 64.37 66.62 0.61 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.012 -1.055 . . . . 40.0 111.03 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 60.76 43.2 12.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.266 -0.896 . . . . 40.0 110.472 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.579 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.6 mm-40 -116.37 -76.81 0.57 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.621 -1.299 . . . . 40.0 109.104 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.515 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.9 p -94.25 122.27 36.61 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.67 -1.269 . . . . 40.0 109.785 -178.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.554 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 4.9 m-85 -104.11 84.73 2.27 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.54 -0.725 . . . . 40.0 110.972 -179.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 m -77.9 144.51 36.84 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.916 -1.115 . . . . 40.0 109.314 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.692 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 60.5 tttp -75.83 147.72 38.93 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.41 -0.806 . . . . 40.0 110.592 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.435 ' O ' ' HG2' ' A' ' 110' ' ' ARG . 38.8 pt -129.81 -31.14 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 109.223 -0.658 . . . . 40.0 109.223 178.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.692 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.15 0 CA-C-O 118.514 -0.755 . . . . 40.0 109.097 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.663 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 109.917 -0.401 . . . . 40.0 109.917 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.573 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.7 mt -140.13 147.79 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 40.0 109.068 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -149.98 35.03 0.67 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.072 -1.017 . . . . 40.0 109.454 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.6 p -119.76 144.07 47.47 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 119.577 -0.849 . . . . 40.0 110.512 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -45.23 -85.56 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 N-CA-C 113.471 0.915 . . . . 40.0 113.471 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.628 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.14 -46.26 17.08 Favored 'General case' 0 C--N 1.288 -2.071 0 O-C-N 121.623 -0.673 . . . . 40.0 110.117 -179.294 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.03 60.45 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.732 -0.947 . . . . 40.0 110.732 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.6 t -66.84 -42.11 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.019 -1.283 . . . . 40.0 108.29 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.418 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -60.51 -55.4 33.88 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.961 -1.087 . . . . 40.0 109.585 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.23 -50.24 62.37 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.478 -0.764 . . . . 40.0 109.186 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.607 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 19.2 t80 -52.78 -49.54 65.37 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.72 0.772 . . . . 40.0 109.81 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.647 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.6 mt -68.6 -45.8 71.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.596 -0.69 . . . . 40.0 109.855 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -64.05 -23.02 67.17 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.6 -1.24 . . . . 40.0 110.625 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.2 m -105.41 -41.76 5.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.66 -1.275 . . . . 40.0 111.66 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.596 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.2 m-85 -103.46 -16.08 15.69 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.762 -1.211 . . . . 40.0 110.846 -177.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.647 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.45 -36.64 0.11 Allowed 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 121.546 0.688 . . . . 40.0 110.662 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.607 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -66.86 118.72 10.75 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 120.83 -1.168 . . . . 40.0 108.265 179.06 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.439 ' HA ' HD23 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -45.51 132.93 6.19 Favored Pre-proline 0 N--CA 1.499 2.02 0 O-C-N 121.366 -0.834 . . . . 40.0 108.923 -179.222 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.479 ' O ' ' N ' ' A' ' 23' ' ' ASN . 62.6 Cg_exo -35.31 134.14 0.2 Allowed 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 122.246 1.964 . . . . 40.0 112.557 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.75 73.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.695 0.759 . . . . 40.0 110.067 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.663 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.0 p-10 174.05 19.23 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.763 -0.585 . . . . 40.0 111.197 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -118.04 162.04 18.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.489 0.662 . . . . 40.0 111.542 -178.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -150.64 152.43 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.275 -0.891 . . . . 40.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.593 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 76.2 p -72.4 151.7 42.46 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.532 -0.73 . . . . 40.0 109.407 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.646 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -48.7 -53.66 17.94 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.121 -1.066 . . . . 40.0 108.121 177.517 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.5 t -46.19 -63.42 0.99 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.547 -0.721 . . . . 40.0 110.312 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.593 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 36.1 mt-10 -48.27 -58.4 4.61 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.202 -0.937 . . . . 40.0 108.962 179.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.72 -49.41 62.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.353 -0.842 . . . . 40.0 110.228 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.443 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 55.6 mt-30 -64.99 -48.97 72.07 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.44 -0.787 . . . . 40.0 110.255 -178.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.28 -31.85 72.9 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.576 -0.703 . . . . 40.0 110.985 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mt -67.68 -19.3 65.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.498 -0.751 . . . . 40.0 109.075 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.483 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 131.14 0.4 5.1 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 119.945 -1.121 . . . . 40.0 111.358 178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -62.61 114.08 3.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.595 -1.532 . . . . 40.0 108.603 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.3 t -122.11 140.92 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.548 0 CA-C-O 121.891 0.853 . . . . 40.0 110.377 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.51 -47.02 85.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.44 -0.787 . . . . 40.0 109.886 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.6 p -77.74 50.42 0.84 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.886 -1.134 . . . . 40.0 109.063 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -175.79 -48.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.137 0.494 . . . . 40.0 109.767 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.5 72.76 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 108.912 -1.675 . . . . 40.0 108.912 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.483 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.3 p-10 -56.04 130.76 45.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.798 -0.825 . . . . 40.0 109.326 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.0 tp -170.1 -58.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.66 -0.867 . . . . 40.0 108.66 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.54 -25.48 52.09 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.388 -0.82 . . . . 40.0 109.673 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.435 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -75.63 -65.22 0.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.0 -0.741 . . . . 40.0 109.0 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.2 m -67.14 -29.83 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.428 -0.795 . . . . 40.0 109.753 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -140.46 77.71 23.19 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.746 -0.596 . . . . 40.0 110.227 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.83 50.02 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 123.276 2.65 . . . . 40.0 113.829 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.18 43.83 0.04 OUTLIER Glycine 0 N--CA 1.497 2.733 0 C-N-CA 119.556 -1.307 . . . . 40.0 111.375 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -121.75 145.04 48.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.874 -1.368 . . . . 40.0 109.436 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 m -119.26 133.74 55.59 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.797 -1.189 . . . . 40.0 110.455 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.457 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.8 mm -65.49 153.48 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.19 -0.944 . . . . 40.0 110.216 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.467 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.37 145.63 4.17 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.525 -1.43 . . . . 40.0 109.525 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 125.42 15.4 3.03 Favored Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.877 -1.154 . . . . 40.0 111.181 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.513 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -74.81 -166.86 0.5 Allowed 'General case' 0 C--O 1.194 -1.863 0 O-C-N 120.576 -1.544 . . . . 40.0 110.332 -179.077 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.5 mm -134.54 139.57 47.52 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.706 0 CA-C-O 121.6 0.714 . . . . 40.0 109.581 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -151.62 146.99 26.22 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.894 -0.78 . . . . 40.0 108.894 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.683 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -94.16 -18.06 22.12 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 40.0 109.672 -179.186 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.6 t30 68.71 30.24 4.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.359 -0.838 . . . . 40.0 111.917 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.683 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 0.9 OUTLIER -57.92 -29.98 65.55 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.904 -1.122 . . . . 40.0 108.134 178.534 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.9 mp0 -64.35 -11.38 31.83 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.324 0.583 . . . . 40.0 109.462 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.2 44.5 98.04 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 110.339 -1.104 . . . . 40.0 110.339 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.584 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -95.48 -12.74 25.36 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.566 -0.961 . . . . 40.0 108.828 179.849 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.482 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 52.3 mt -136.8 162.17 57.49 Favored Pre-proline 0 N--CA 1.497 1.912 0 N-CA-C 108.318 -0.993 . . . . 40.0 108.318 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.493 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 86.6 Cg_exo -43.75 142.36 3.47 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 122.103 1.869 . . . . 40.0 112.667 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.624 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.77 -165.94 11.35 Favored Glycine 0 N--CA 1.492 2.429 0 C-N-CA 120.018 -1.087 . . . . 40.0 110.915 -178.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.635 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.3 pttm 173.5 -157.79 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 107.775 -1.194 . . . . 40.0 107.775 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.6 p -73.54 86.23 1.57 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 106.983 -1.488 . . . . 40.0 106.983 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.635 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.91 99.59 0.23 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.295 -1.522 . . . . 40.0 109.295 -178.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.626 HH11 ' CG ' ' A' ' 93' ' ' ASP . 18.5 tpp180 -121.85 140.84 51.89 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.388 -1.066 . . . . 40.0 110.031 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.732 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 24.8 p -109.4 130.83 55.48 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 108.123 -1.066 . . . . 40.0 108.123 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.493 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 33.8 m95 -121.82 143.69 49.26 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.324 -0.86 . . . . 40.0 111.16 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.556 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.1 mpp_? -141.61 147.5 37.73 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.453 -0.779 . . . . 40.0 109.692 -178.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.646 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -119.24 169.82 9.64 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 119.551 -0.86 . . . . 40.0 112.058 179.897 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.467 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -157.34 145.27 19.05 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.521 -0.737 . . . . 40.0 110.272 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.636 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -69.36 151.93 45.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.667 -0.645 . . . . 40.0 110.292 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.424 HG13 ' HB ' ' A' ' 88' ' ' ILE . 14.5 mm -135.95 152.65 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.178 -0.951 . . . . 40.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.5 HD21 ' CG ' ' A' ' 86' ' ' ASP . 75.1 m-20 57.94 51.15 9.3 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.01 0.433 . . . . 40.0 111.507 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.474 ' CG ' ' N ' ' A' ' 79' ' ' THR . 57.1 t80 -116.85 153.13 33.05 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.972 -1.08 . . . . 40.0 109.217 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.604 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.7 p -132.8 -77.55 0.49 Allowed 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.854 0.835 . . . . 40.0 109.608 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.604 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.58 102.28 2.71 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 109.442 -0.577 . . . . 40.0 109.442 -179.392 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 153.09 -104.27 0.25 Allowed Glycine 0 N--CA 1.499 2.874 0 N-CA-C 109.841 -1.304 . . . . 40.0 109.841 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 11.8 t80 -126.03 -179.41 4.69 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.681 -0.894 . . . . 40.0 109.91 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.46 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.3 mtm180 -80.96 -150.87 0.08 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 121.581 0.705 . . . . 40.0 110.049 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.413 HD22 ' HB2' ' A' ' 77' ' ' ASN . 27.3 p30 -164.3 -136.62 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.182 -1.044 . . . . 40.0 108.182 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.6 p -114.04 -9.12 13.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.808 -1.183 . . . . 40.0 109.192 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.5 ' CG ' HD21 ' A' ' 77' ' ' ASN . 18.3 m-20 -73.69 109.36 7.14 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.287 -0.415 . . . . 40.0 110.394 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.787 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.12 137.25 40.81 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.369 -0.832 . . . . 40.0 110.258 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.424 ' HB ' HG13 ' A' ' 76' ' ' ILE . 15.2 tt -108.39 145.88 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 122.61 1.195 . . . . 40.0 110.592 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -123.1 127.23 48.44 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.841 -0.8 . . . . 40.0 108.841 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.0 p90 -132.05 140.72 48.98 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.746 -0.835 . . . . 40.0 108.746 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.487 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.6 p -107.23 178.46 4.54 Favored 'General case' 0 N--CA 1.51 2.56 0 CA-C-O 122.511 1.148 . . . . 40.0 112.662 -176.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.732 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -49.77 -54.97 15.84 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.569 1.176 . . . . 40.0 108.353 177.164 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.626 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -67.75 6.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.51 -1.223 . . . . 40.0 111.098 -178.848 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.427 ' H ' ' C ' ' A' ' 92' ' ' SER . 67.4 m95 70.76 15.22 6.97 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.807 -0.558 . . . . 40.0 112.172 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.9 mt -70.37 127.14 31.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.169 -1.582 . . . . 40.0 106.819 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.418 HD11 ' CB ' ' A' ' 11' ' ' ALA . 2.3 mp -113.92 135.21 54.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-O 123.004 1.383 . . . . 40.0 112.224 -177.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.633 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.0 m-85 -128.43 158.17 39.06 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.577 -1.268 . . . . 40.0 107.577 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.437 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.9 ptmm? -126.69 145.97 50.38 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.714 -1.195 . . . . 40.0 112.566 -178.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.93 130.58 33.94 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.282 -1.377 . . . . 40.0 107.282 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.4 p -116.13 11.07 15.14 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.234 -0.654 . . . . 40.0 109.234 -177.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.562 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -117.29 34.71 4.99 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.723 -0.791 . . . . 40.0 109.498 178.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.8 68.33 0.7 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.431 -0.793 . . . . 40.0 111.02 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 60.1 43.85 13.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.429 -0.795 . . . . 40.0 110.279 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.562 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 28.7 mm-40 -116.47 -77.89 0.57 Allowed 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.833 -1.167 . . . . 40.0 108.66 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.483 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.4 p -94.25 120.21 34.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.737 -1.227 . . . . 40.0 110.642 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.584 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 10.0 m-85 -101.01 82.73 2.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.342 -0.848 . . . . 40.0 111.589 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.2 m -75.54 142.1 42.86 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.038 -1.038 . . . . 40.0 109.372 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.643 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 61.4 tttp -76.45 148.87 36.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.539 -0.726 . . . . 40.0 110.452 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.43 ' O ' ' HG2' ' A' ' 110' ' ' ARG . 32.7 pt -131.4 -30.13 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 109.144 -0.687 . . . . 40.0 109.144 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.643 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.903 0 CA-C-O 118.394 -0.812 . . . . 40.0 109.088 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.68 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.5 t . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.176 -0.676 . . . . 40.0 109.176 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.554 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.05 150.34 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.468 -0.77 . . . . 40.0 108.992 -179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -150.06 35.15 0.66 Allowed 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.159 -0.963 . . . . 40.0 109.397 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.4 p -119.27 141.58 48.83 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.924 -0.71 . . . . 40.0 110.331 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -43.54 -84.39 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.024 0.916 . . . . 40.0 112.904 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.591 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.97 -47.09 21.92 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 121.724 -0.61 . . . . 40.0 110.08 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.05 -48.53 62.66 Favored Glycine 0 N--CA 1.502 3.046 0 N-CA-C 110.497 -1.041 . . . . 40.0 110.497 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -44.11 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.4 . . . . 40.0 108.452 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.417 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -57.81 -58.04 10.11 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.607 -0.683 . . . . 40.0 110.12 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -51.11 61.35 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.693 -0.855 . . . . 40.0 108.693 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.616 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.9 t80 -50.35 -50.21 51.78 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.931 0.872 . . . . 40.0 109.671 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.561 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 24.4 mt -69.69 -45.17 68.9 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.543 -0.723 . . . . 40.0 110.481 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -63.53 -20.89 66.0 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 119.411 -0.915 . . . . 40.0 111.417 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.1 m -105.73 -45.02 4.51 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.692 -1.255 . . . . 40.0 111.463 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.602 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.6 m-85 -102.9 -15.07 16.29 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.351 -0.843 . . . . 40.0 110.913 -177.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.561 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-70 60.6 -30.5 0.06 Allowed 'General case' 0 N--CA 1.505 2.322 0 CA-C-O 121.447 0.641 . . . . 40.0 111.045 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.616 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -69.72 117.99 12.02 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.695 -1.253 . . . . 40.0 108.792 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.424 HD21 ' HD2' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -46.5 132.17 7.98 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.47 -0.769 . . . . 40.0 109.427 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.424 ' HD2' HD21 ' A' ' 20' ' ' LEU . 67.7 Cg_exo -36.59 133.66 0.35 Allowed 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.866 2.377 . . . . 40.0 112.5 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.566 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -64.67 75.62 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.011 0.91 . . . . 40.0 110.433 -179.174 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.68 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 174.0 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.733 -0.605 . . . . 40.0 110.406 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.449 ' HA ' ' O ' ' A' ' 50' ' ' SER . 18.1 m-85 -114.52 163.96 14.65 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.426 -0.796 . . . . 40.0 111.396 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.98 152.06 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.45 -0.781 . . . . 40.0 109.417 178.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.593 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 61.2 p -72.39 150.75 43.13 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 108.909 -0.774 . . . . 40.0 108.909 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.641 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -49.98 -52.19 35.67 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.529 -0.915 . . . . 40.0 108.529 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -46.74 -61.58 1.78 Allowed 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.446 -0.784 . . . . 40.0 110.268 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.593 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 41.8 mt-10 -50.76 -56.64 11.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.153 -0.967 . . . . 40.0 109.234 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.97 -49.02 66.96 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.459 -0.776 . . . . 40.0 109.739 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.4 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 50.2 mt-30 -65.65 -49.22 69.43 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.751 -0.593 . . . . 40.0 110.291 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.68 -31.04 70.74 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.399 -0.813 . . . . 40.0 110.351 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.38 -18.85 65.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.134 -0.979 . . . . 40.0 109.267 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.55 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 133.04 -4.2 4.95 Favored Glycine 0 N--CA 1.497 2.719 0 C-N-CA 119.871 -1.157 . . . . 40.0 111.087 178.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -62.02 116.04 4.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.544 -1.562 . . . . 40.0 108.746 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 31.0 t -124.12 142.6 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 121.87 0.843 . . . . 40.0 110.506 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.06 83.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.353 -0.842 . . . . 40.0 110.561 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 p -77.68 48.17 0.66 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.825 -1.172 . . . . 40.0 109.318 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -173.58 -50.3 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.572 -0.705 . . . . 40.0 109.328 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.18 24.59 76.5 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 108.974 -1.651 . . . . 40.0 108.974 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.55 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.8 p-10 -58.77 130.83 48.8 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.748 -0.854 . . . . 40.0 109.42 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.523 ' O ' ' N ' ' A' ' 46' ' ' ALA . 5.2 tp -170.77 -56.69 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.295 -1.002 . . . . 40.0 108.295 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.09 -23.27 32.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 40.0 109.906 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.485 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -78.79 -66.28 0.88 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.899 -0.778 . . . . 40.0 108.899 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.436 ' H ' ' CG ' ' A' ' 44' ' ' ASP . 24.5 m -67.32 -26.98 37.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 109.079 -0.712 . . . . 40.0 109.079 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.562 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -142.5 77.97 16.77 Favored Pre-proline 0 N--CA 1.488 1.443 0 O-C-N 121.411 -0.806 . . . . 40.0 109.982 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.95 50.01 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.972 2.448 . . . . 40.0 113.966 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.44 42.22 0.05 OUTLIER Glycine 0 N--CA 1.5 2.942 0 C-N-CA 119.766 -1.207 . . . . 40.0 111.338 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.445 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 13.4 tttt -119.83 147.69 44.36 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.906 -1.349 . . . . 40.0 110.035 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.449 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 13.1 m -117.6 134.1 55.24 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.155 -0.965 . . . . 40.0 109.994 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.3 mm -67.47 154.89 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.921 -1.112 . . . . 40.0 110.589 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 149.63 150.62 5.29 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.491 -1.338 . . . . 40.0 110.049 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 122.34 17.04 3.7 Favored Glycine 0 N--CA 1.494 2.561 0 O-C-N 121.213 -1.169 . . . . 40.0 110.739 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.641 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -75.64 -167.65 0.72 Allowed 'General case' 0 C--O 1.198 -1.628 0 O-C-N 120.989 -1.301 . . . . 40.0 110.426 -179.345 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.462 HG21 HD12 ' A' ' 55' ' ' ILE . 3.8 mm -134.46 141.56 43.13 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.542 0 CA-C-O 121.506 0.669 . . . . 40.0 110.239 -179.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -153.46 145.91 24.06 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.173 -0.954 . . . . 40.0 110.033 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.655 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -92.24 -17.54 24.67 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.444 -0.785 . . . . 40.0 110.14 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.451 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 66.5 t30 67.21 32.9 5.79 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.06 -1.025 . . . . 40.0 111.419 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.664 ' HB2' ' CZ ' ' A' ' 59' ' ' ARG . 0.8 OUTLIER -60.84 -29.32 69.43 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.981 -1.074 . . . . 40.0 108.439 178.529 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.437 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 23.8 mp0 -64.63 -13.91 55.72 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.526 -0.546 . . . . 40.0 109.526 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.25 42.69 94.05 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 109.683 -1.367 . . . . 40.0 109.683 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.556 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -95.57 -10.27 30.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.647 -0.914 . . . . 40.0 109.197 -179.592 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.451 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 30.7 mt -138.94 164.05 42.12 Favored Pre-proline 0 N--CA 1.492 1.659 0 N-CA-C 108.535 -0.913 . . . . 40.0 108.535 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.624 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 87.0 Cg_exo -45.16 139.91 8.16 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.025 1.817 . . . . 40.0 111.659 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.643 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.04 -166.29 11.69 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 110.392 -1.083 . . . . 40.0 110.392 -178.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.611 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 pttm 173.33 -158.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 107.859 -1.163 . . . . 40.0 107.859 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.2 p -73.64 85.42 1.6 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.165 -1.42 . . . . 40.0 107.165 177.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.611 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 79.72 99.94 0.28 Allowed Glycine 0 N--CA 1.496 2.679 0 N-CA-C 108.863 -1.695 . . . . 40.0 108.863 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.643 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 16.9 tpp180 -123.45 140.89 52.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.535 -0.979 . . . . 40.0 110.508 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.746 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 29.5 p -108.83 130.25 55.4 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.632 -0.877 . . . . 40.0 108.632 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.624 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 30.7 m95 -121.48 146.85 46.49 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.343 -0.848 . . . . 40.0 110.381 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.62 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.9 OUTLIER -145.89 146.88 31.26 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.538 -0.726 . . . . 40.0 109.624 -179.21 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.613 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.3 170.72 8.32 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.177 -1.009 . . . . 40.0 112.352 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.449 ' O ' HG22 ' A' ' 88' ' ' ILE . . . -157.36 145.41 19.13 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.487 -0.758 . . . . 40.0 109.981 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.663 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -70.44 153.25 43.16 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.551 -0.718 . . . . 40.0 110.408 -179.206 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.44 HG13 ' HB ' ' A' ' 88' ' ' ILE . 17.8 mm -137.61 153.37 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 40.0 110.088 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.473 HD21 ' CG ' ' A' ' 86' ' ' ASP . 73.8 m-20 55.07 58.49 4.69 Favored 'General case' 0 N--CA 1.5 2.033 0 CA-C-O 121.186 0.517 . . . . 40.0 111.267 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.488 ' CG ' ' N ' ' A' ' 79' ' ' THR . 56.1 t80 -121.83 155.2 35.87 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 40.0 108.739 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.556 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.8 p -132.32 -79.91 0.5 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 121.672 0.749 . . . . 40.0 109.84 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.556 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.27 101.67 2.86 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.88 -0.785 . . . . 40.0 108.88 -179.284 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.14 -109.09 0.4 Allowed Glycine 0 N--CA 1.5 2.952 0 C-N-CA 119.753 -1.213 . . . . 40.0 110.108 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.445 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.5 t80 -119.42 -177.97 3.49 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.358 -1.084 . . . . 40.0 110.06 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.445 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 4.2 mtm180 -84.47 -150.33 0.12 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.463 -0.773 . . . . 40.0 110.561 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -164.98 -135.93 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.743 -0.836 . . . . 40.0 108.743 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 45.6 p -114.21 -10.25 12.77 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.835 -1.166 . . . . 40.0 109.417 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.473 ' CG ' HD21 ' A' ' 77' ' ' ASN . 15.5 m-20 -73.04 106.43 4.91 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.95 0.405 . . . . 40.0 110.131 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.812 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -134.05 139.27 45.88 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 119.585 -0.846 . . . . 40.0 110.172 179.768 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 74' ' ' ALA . 18.1 tt -110.12 148.78 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-O 122.064 0.935 . . . . 40.0 110.56 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.427 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.0 mm? -125.21 128.5 48.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.582 -0.699 . . . . 40.0 109.393 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.62 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.4 p90 -131.07 141.71 50.21 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 109.043 -0.725 . . . . 40.0 109.043 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.536 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 60.0 p -107.28 -179.11 3.83 Favored 'General case' 0 N--CA 1.504 2.252 0 CA-C-O 122.162 0.982 . . . . 40.0 112.209 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.746 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -54.55 -53.6 52.33 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.324 1.059 . . . . 40.0 108.794 177.735 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.583 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -65.9 2.2 1.14 Allowed 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 114.643 -1.162 . . . . 40.0 109.975 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.487 ' HB2' ' O ' ' A' ' 93' ' ' ASP . 78.5 m95 73.56 16.85 3.88 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 122.017 -0.427 . . . . 40.0 111.652 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 24.4 mt -70.52 126.56 29.97 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 106.79 -1.559 . . . . 40.0 106.79 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.417 HD11 ' CB ' ' A' ' 11' ' ' ALA . 2.7 mp -114.26 134.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 122.706 1.241 . . . . 40.0 112.013 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.53 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 10.3 m-85 -127.68 158.88 36.4 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.95 -1.13 . . . . 40.0 107.95 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.413 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.4 ptmm? -127.13 145.79 50.62 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 118.634 -1.226 . . . . 40.0 112.291 -178.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.426 HG22 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.97 129.81 32.69 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 106.897 -1.52 . . . . 40.0 106.897 177.433 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.4 p -115.98 9.93 15.0 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 109.585 -0.524 . . . . 40.0 109.585 -177.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.573 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.2 34.21 5.0 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.821 -0.751 . . . . 40.0 109.818 178.947 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 62.46 67.47 0.72 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.16 -0.963 . . . . 40.0 111.077 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 61.15 43.21 11.34 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -0.825 . . . . 40.0 110.451 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.573 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.5 mm-40 -115.88 -77.92 0.57 Allowed 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.614 -1.304 . . . . 40.0 109.267 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.484 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.2 p -93.74 120.82 34.51 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.068 -1.02 . . . . 40.0 110.207 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.556 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 6.1 m-85 -102.73 83.77 2.31 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.378 0.609 . . . . 40.0 110.685 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.28 144.88 35.75 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.213 -0.995 . . . . 40.0 108.903 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.669 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 57.8 tttp -76.67 146.99 37.75 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.214 0.53 . . . . 40.0 110.322 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.424 ' O ' ' HG2' ' A' ' 110' ' ' ARG . 15.6 pt -130.22 -28.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 109.148 -0.686 . . . . 40.0 109.148 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.669 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 N-CA-C 109.128 -0.693 . . . . 40.0 109.128 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.676 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.8 t . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 109.249 -0.649 . . . . 40.0 109.249 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.589 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 10.6 mt -139.24 147.7 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.453 -0.78 . . . . 40.0 109.415 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -149.55 34.4 0.7 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.276 -0.89 . . . . 40.0 109.712 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.3 p -119.51 144.75 46.85 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.913 -0.715 . . . . 40.0 110.115 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -45.6 -86.83 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.49 -0.757 . . . . 40.0 112.752 -178.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.625 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -46.18 -48.05 17.61 Favored 'General case' 0 C--N 1.289 -2.061 0 O-C-N 121.672 -0.643 . . . . 40.0 109.761 -178.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.14 -53.35 23.62 Favored Glycine 0 N--CA 1.502 3.071 0 N-CA-C 110.149 -1.18 . . . . 40.0 110.149 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.83 -44.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 O-C-N 120.867 -1.372 . . . . 40.0 109.733 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.76 -57.06 14.09 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.257 -0.902 . . . . 40.0 109.934 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.99 -47.05 65.07 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 178.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.452 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.7 t80 -54.63 -50.26 68.54 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.901 0.858 . . . . 40.0 109.057 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.686 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 72.2 mt -70.72 -44.7 66.31 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.727 -0.608 . . . . 40.0 110.618 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.401 ' HG3' HD13 ' A' ' 96' ' ' ILE . 4.9 mt-30 -61.73 -26.86 68.32 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 119.122 -1.031 . . . . 40.0 110.722 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.9 m -102.28 -44.22 5.47 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.872 -1.143 . . . . 40.0 111.926 -178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.612 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.5 m-85 -102.85 -16.2 15.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.906 -1.121 . . . . 40.0 110.425 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.686 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 62.1 -27.58 0.06 Allowed 'General case' 0 N--CA 1.502 2.169 0 CA-C-O 121.36 0.6 . . . . 40.0 110.895 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.612 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -71.28 122.41 20.21 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 120.82 -1.175 . . . . 40.0 108.756 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.0 mt -47.29 132.36 9.76 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.428 -0.795 . . . . 40.0 109.144 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -40.0 131.71 2.07 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 122.199 1.932 . . . . 40.0 112.626 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.625 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.47 78.59 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.876 0.845 . . . . 40.0 110.335 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.676 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 170.47 15.17 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.915 -0.491 . . . . 40.0 110.503 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.426 ' HA ' ' O ' ' A' ' 50' ' ' SER . 17.5 m-85 -114.18 167.13 10.95 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.497 -0.752 . . . . 40.0 111.233 -179.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.55 152.1 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 40.0 109.049 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.595 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 77.8 p -72.17 151.67 42.8 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 108.405 -0.961 . . . . 40.0 108.405 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.646 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -50.83 -51.9 46.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.759 -1.213 . . . . 40.0 108.38 177.883 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.7 t -46.32 -62.91 1.14 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.841 -0.537 . . . . 40.0 110.252 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.595 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 45.2 mt-10 -48.74 -58.02 5.42 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.019 -0.734 . . . . 40.0 109.019 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.18 -49.33 64.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.591 -0.693 . . . . 40.0 109.575 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -64.86 -48.21 75.11 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.369 -0.832 . . . . 40.0 111.034 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -31.8 72.1 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 40.0 110.746 -179.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.92 -20.51 65.92 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.77 -0.826 . . . . 40.0 108.77 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.532 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 132.61 -3.66 5.05 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 120.127 -1.035 . . . . 40.0 111.031 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -60.94 114.32 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.549 -1.56 . . . . 40.0 108.318 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.8 142.85 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.376 -0.828 . . . . 40.0 110.48 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.46 -48.97 79.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.495 -0.753 . . . . 40.0 110.648 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 p -78.09 46.88 0.62 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.112 -0.992 . . . . 40.0 109.147 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -169.92 -50.37 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 108.824 -0.806 . . . . 40.0 108.824 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.92 20.23 75.96 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.1 -1.6 . . . . 40.0 109.1 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.532 HD22 ' C ' ' A' ' 34' ' ' GLY . 6.7 p-10 -55.19 127.23 28.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.68 -0.894 . . . . 40.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 46' ' ' ALA . 5.4 tp -166.83 -55.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 108.533 -0.914 . . . . 40.0 108.533 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -29.74 53.41 Favored 'General case' 0 C--N 1.288 -2.069 0 O-C-N 121.052 -1.03 . . . . 40.0 110.065 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -62.73 1.34 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.396 -0.815 . . . . 40.0 109.443 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.403 ' H ' HG22 ' A' ' 45' ' ' VAL . 24.4 m -71.57 -23.18 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-N 116.23 -0.441 . . . . 40.0 109.988 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.551 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -148.11 76.2 10.44 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 120.981 -1.075 . . . . 40.0 108.937 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -58.73 53.27 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.504 0 C-N-CA 122.391 2.06 . . . . 40.0 113.274 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.69 38.05 0.06 OUTLIER Glycine 0 N--CA 1.5 2.951 0 C-N-CA 119.913 -1.137 . . . . 40.0 111.577 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 19.9 tttt -119.72 148.34 43.51 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.795 -1.415 . . . . 40.0 110.092 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.426 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 5.2 m -120.26 134.8 55.19 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.136 -0.978 . . . . 40.0 109.93 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.452 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.9 mm -67.05 155.35 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -0.966 . . . . 40.0 110.815 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.477 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.43 148.08 4.67 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 119.615 -1.279 . . . . 40.0 110.257 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 123.53 15.99 3.53 Favored Glycine 0 N--CA 1.496 2.642 0 C-N-CA 119.865 -1.159 . . . . 40.0 110.997 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.646 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -74.31 -168.87 0.71 Allowed 'General case' 0 C--O 1.192 -1.936 0 O-C-N 121.04 -1.27 . . . . 40.0 110.386 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -132.85 140.92 46.26 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 CA-C-O 121.728 0.775 . . . . 40.0 110.423 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -153.43 148.12 26.31 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.475 -0.765 . . . . 40.0 109.149 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.682 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.29 -19.96 20.22 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.465 -0.772 . . . . 40.0 110.211 -179.165 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.8 t30 69.95 31.19 3.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.448 -0.782 . . . . 40.0 111.889 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.682 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.4 mtm-85 -59.02 -31.15 68.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.821 -1.174 . . . . 40.0 108.129 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.466 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 22.0 mp0 -62.88 -8.92 7.95 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.228 -0.656 . . . . 40.0 109.228 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 58.55 44.05 95.7 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.367 -1.093 . . . . 40.0 110.367 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.598 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -95.61 -12.29 25.86 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.61 -0.935 . . . . 40.0 108.78 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.479 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 28.3 mt -136.2 162.69 55.06 Favored Pre-proline 0 N--CA 1.499 2.024 0 N-CA-C 108.135 -1.061 . . . . 40.0 108.135 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.464 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 93.5 Cg_exo -42.78 142.32 2.14 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 121.98 1.786 . . . . 40.0 112.622 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.609 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.62 -166.42 11.5 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.002 -1.239 . . . . 40.0 110.002 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.557 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.0 pttm 171.5 -158.48 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 107.126 -1.435 . . . . 40.0 107.126 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.0 p -72.4 87.71 1.17 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 107.012 -1.477 . . . . 40.0 107.012 177.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.557 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.42 103.97 0.11 Allowed Glycine 0 N--CA 1.498 2.772 0 N-CA-C 109.559 -1.416 . . . . 40.0 109.559 -178.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.62 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -124.02 140.85 52.57 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.529 -0.983 . . . . 40.0 110.347 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.777 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 24.1 p -105.99 130.04 54.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.279 -1.008 . . . . 40.0 108.279 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.544 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 31.3 m95 -124.27 140.38 53.02 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.726 -0.789 . . . . 40.0 110.585 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.533 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.7 OUTLIER -143.5 149.55 37.67 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.286 -0.883 . . . . 40.0 108.926 -179.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.636 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -116.76 175.34 5.62 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.293 -0.879 . . . . 40.0 112.65 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.477 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -162.24 142.53 10.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.557 -0.715 . . . . 40.0 110.27 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.65 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -67.73 153.17 44.31 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.74 -0.6 . . . . 40.0 110.844 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.438 HG13 ' HB ' ' A' ' 88' ' ' ILE . 13.8 mm -136.93 151.61 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.382 -0.823 . . . . 40.0 109.798 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.473 HD21 ' CG ' ' A' ' 86' ' ' ASP . 76.9 m-20 57.27 53.71 7.43 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.143 0.496 . . . . 40.0 111.98 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.469 ' CG ' ' N ' ' A' ' 79' ' ' THR . 60.3 t80 -118.1 155.14 30.91 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.159 -0.963 . . . . 40.0 109.123 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.565 ' OG1' ' N ' ' A' ' 80' ' ' SER . 42.0 p -133.28 -78.2 0.48 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.716 0.769 . . . . 40.0 109.876 178.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.565 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.74 102.94 2.89 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 109.078 -0.712 . . . . 40.0 109.078 -179.546 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -105.95 0.29 Allowed Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.788 -1.325 . . . . 40.0 109.788 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.431 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 14.1 t80 -126.38 -175.83 3.49 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -1.031 . . . . 40.0 109.942 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.432 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.5 mtm180 -84.75 -153.44 0.16 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.417 -0.802 . . . . 40.0 110.38 -178.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -163.7 -135.13 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.759 -0.83 . . . . 40.0 108.759 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 28.1 p -113.84 -10.55 12.96 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.975 -1.078 . . . . 40.0 109.791 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.473 ' CG ' HD21 ' A' ' 77' ' ' ASN . 14.1 m-20 -73.91 108.21 6.59 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 120.858 0.361 . . . . 40.0 110.821 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.787 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.03 140.48 45.64 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.469 -0.892 . . . . 40.0 110.391 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.438 ' HB ' HG13 ' A' ' 76' ' ' ILE . 18.1 tt -111.33 148.33 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 CA-C-O 122.108 0.956 . . . . 40.0 109.917 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -124.82 128.74 49.18 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.478 -0.764 . . . . 40.0 109.082 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.459 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.25 141.58 50.02 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.273 -0.892 . . . . 40.0 109.67 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.544 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.7 p -106.52 179.57 4.23 Favored 'General case' 0 N--CA 1.505 2.314 0 CA-C-O 122.51 1.148 . . . . 40.0 112.666 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.777 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.82 -51.98 58.8 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.381 1.086 . . . . 40.0 109.118 177.863 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.62 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 5.1 1.24 Allowed 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 114.673 -1.149 . . . . 40.0 110.2 -178.955 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.509 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 61.6 m95 72.76 11.52 5.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.882 -0.511 . . . . 40.0 112.097 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 23.1 mt -67.73 125.14 25.29 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 119.947 -1.72 . . . . 40.0 107.835 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.415 HG21 HD12 ' A' ' 109' ' ' ILE . 2.2 mt -112.62 133.25 59.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 122.865 1.317 . . . . 40.0 112.724 -176.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.568 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 16.0 m-85 -125.21 157.68 35.89 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 107.77 -1.196 . . . . 40.0 107.77 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.417 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.92 141.24 51.6 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 119.205 -0.998 . . . . 40.0 112.934 -177.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.83 131.33 40.9 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.484 -1.302 . . . . 40.0 107.484 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.9 p -116.44 10.35 14.6 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 109.397 -0.594 . . . . 40.0 109.397 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.549 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -115.3 33.16 5.6 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.585 -0.846 . . . . 40.0 109.854 179.293 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 63.98 66.68 0.64 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.262 -0.899 . . . . 40.0 111.071 178.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 60.88 43.25 12.03 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.386 -0.821 . . . . 40.0 110.108 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.549 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.4 mm-40 -116.26 -76.92 0.57 Allowed 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.712 -1.243 . . . . 40.0 109.217 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.529 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.9 p -94.81 121.96 36.94 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.664 -1.273 . . . . 40.0 110.433 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.598 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -102.9 86.14 2.67 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 40.0 110.584 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.5 m -79.28 146.42 32.99 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.197 -1.001 . . . . 40.0 108.334 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.644 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 57.5 tttp -78.28 146.32 34.89 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.304 0.573 . . . . 40.0 110.371 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.441 ' O ' ' HG2' ' A' ' 110' ' ' ARG . 29.1 pt -126.97 -31.66 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 N-CA-C 108.933 -0.766 . . . . 40.0 108.933 177.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.644 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.586 -0.721 . . . . 40.0 109.269 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.651 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.7 t . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 109.488 -0.56 . . . . 40.0 109.488 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.528 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.3 mt -137.97 149.74 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.461 -0.774 . . . . 40.0 109.419 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -149.22 36.07 0.74 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.046 -1.034 . . . . 40.0 109.745 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p -119.9 140.51 50.75 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.451 -0.9 . . . . 40.0 110.518 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -41.2 -80.66 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.179 0.514 . . . . 40.0 111.746 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.54 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -50.65 -45.83 58.07 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.566 -0.709 . . . . 40.0 111.108 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.04 -52.0 37.69 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 109.977 -1.249 . . . . 40.0 109.977 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.47 -44.27 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.404 -1.056 . . . . 40.0 109.672 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.462 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -58.66 -55.04 40.17 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.681 0.753 . . . . 40.0 109.408 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -44.36 88.66 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.953 -0.758 . . . . 40.0 108.953 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.513 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.9 t80 -56.91 -48.24 78.7 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 122.233 1.016 . . . . 40.0 108.52 178.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.438 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 39.8 mt -68.73 -45.7 70.82 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.774 -0.579 . . . . 40.0 110.3 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -65.17 -24.34 67.35 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 118.66 -1.216 . . . . 40.0 111.22 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.3 m -98.27 -43.79 6.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.845 -1.159 . . . . 40.0 111.571 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.599 ' C ' ' H ' ' A' ' 19' ' ' LYS . 74.5 m-85 -108.98 -11.98 14.92 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.188 -0.945 . . . . 40.0 111.223 -177.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.497 ' CG ' ' CZ2' ' A' ' 94' ' ' TRP . 2.3 m-70 61.27 -25.62 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 121.567 0.699 . . . . 40.0 111.041 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.599 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -72.9 121.55 20.19 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 120.313 -1.492 . . . . 40.0 108.988 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.02 129.34 12.07 Favored Pre-proline 0 C--N 1.283 -2.309 0 O-C-N 121.463 -0.773 . . . . 40.0 109.281 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.426 ' O ' ' N ' ' A' ' 23' ' ' ASN . 73.9 Cg_exo -33.62 133.48 0.12 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.624 2.216 . . . . 40.0 113.052 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.588 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -64.0 74.98 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.653 0.739 . . . . 40.0 110.258 -179.354 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.651 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 171.72 18.21 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.719 -0.613 . . . . 40.0 110.322 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -115.28 165.15 13.27 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.601 -0.687 . . . . 40.0 110.735 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -155.93 149.87 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 108.744 -0.835 . . . . 40.0 108.744 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.559 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 69.8 p -69.47 153.68 43.16 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.422 -0.799 . . . . 40.0 110.02 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.29 -51.46 58.44 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.14 -1.43 . . . . 40.0 107.14 177.042 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.8 t -47.36 -62.23 1.53 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.48 -0.763 . . . . 40.0 110.362 178.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.559 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 38.9 mt-10 -49.28 -57.2 7.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.356 -0.84 . . . . 40.0 109.356 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.04 -49.43 66.33 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.674 0.749 . . . . 40.0 109.79 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -63.58 -49.59 72.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.728 -0.607 . . . . 40.0 110.16 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.51 -30.02 68.75 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 40.0 110.519 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 mt -66.72 -19.73 65.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.107 -0.996 . . . . 40.0 109.077 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.489 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 131.74 -1.4 5.14 Favored Glycine 0 N--CA 1.499 2.835 0 C-N-CA 120.073 -1.061 . . . . 40.0 111.143 179.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -61.54 114.88 3.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.657 -1.496 . . . . 40.0 109.301 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.8 t -123.32 140.24 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 O-C-N 121.262 -0.899 . . . . 40.0 109.962 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.39 -49.36 78.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 40.0 110.171 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 p -76.64 47.55 0.5 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.218 -0.926 . . . . 40.0 109.425 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -170.89 -49.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.645 -0.659 . . . . 40.0 109.283 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.62 17.4 74.78 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 109.173 -1.571 . . . . 40.0 109.173 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.489 HD22 ' C ' ' A' ' 34' ' ' GLY . 7.4 p-10 -55.61 130.95 45.09 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.455 -1.026 . . . . 40.0 108.946 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 46' ' ' ALA . 1.4 tp -169.85 -55.77 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.704 -1.221 . . . . 40.0 107.704 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.76 -27.38 63.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.324 -0.86 . . . . 40.0 110.241 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.02 -57.31 3.95 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.847 0.832 . . . . 40.0 109.455 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.2 m -72.54 -29.4 30.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.955 -1.128 . . . . 40.0 107.955 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.552 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . -143.05 79.38 14.48 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 121.557 -0.714 . . . . 40.0 110.306 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.11 54.9 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 122.081 1.854 . . . . 40.0 113.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.12 40.7 0.06 OUTLIER Glycine 0 N--CA 1.503 3.135 0 C-N-CA 119.758 -1.211 . . . . 40.0 111.408 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -121.54 138.99 54.07 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.947 -1.325 . . . . 40.0 109.872 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 m -111.99 132.43 54.79 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.032 -1.043 . . . . 40.0 109.283 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.483 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.3 mm -63.54 151.29 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.373 -0.829 . . . . 40.0 110.028 -179.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.98 144.49 3.92 Favored Glycine 0 N--CA 1.488 2.116 0 C-N-CA 118.789 -1.672 . . . . 40.0 110.651 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 126.79 15.33 2.64 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 119.841 -1.171 . . . . 40.0 111.225 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.654 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -72.79 -170.36 0.69 Allowed 'General case' 0 C--O 1.198 -1.63 0 O-C-N 120.841 -1.388 . . . . 40.0 110.205 -179.291 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 5.6 mm -134.11 138.96 49.27 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-O 121.489 0.662 . . . . 40.0 110.203 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -151.03 148.83 28.83 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.581 -0.699 . . . . 40.0 109.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.612 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.68 -21.16 19.53 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.504 -0.748 . . . . 40.0 110.777 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 66.3 t30 71.12 28.12 3.15 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 40.0 111.839 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.612 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.7 mtm-85 -56.64 -32.36 65.27 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.957 -1.089 . . . . 40.0 108.151 178.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.433 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 24.6 mp0 -63.46 -9.22 11.73 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.401 -0.592 . . . . 40.0 109.401 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.93 44.66 97.86 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.236 -1.146 . . . . 40.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.634 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -93.8 -12.85 28.16 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.649 -0.912 . . . . 40.0 108.552 179.679 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.488 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 36.5 mt -138.04 166.57 25.01 Favored Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 108.744 -0.836 . . . . 40.0 108.744 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.619 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 81.7 Cg_exo -46.36 136.57 15.11 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 121.862 1.708 . . . . 40.0 112.387 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.622 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -125.81 -168.56 12.7 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.436 -1.466 . . . . 40.0 109.436 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.592 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 4.0 pttm 175.35 -156.28 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 106.867 -1.531 . . . . 40.0 106.867 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.2 p -75.85 87.15 2.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.32 -1.487 . . . . 40.0 107.155 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.592 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 76.89 105.83 0.15 Allowed Glycine 0 N--CA 1.497 2.756 0 N-CA-C 108.262 -1.935 . . . . 40.0 108.262 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.622 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.1 tpp180 -128.08 142.72 51.13 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.388 -1.066 . . . . 40.0 110.419 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.729 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.75 130.07 55.37 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 108.89 -0.782 . . . . 40.0 108.89 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.619 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 31.3 m95 -123.33 143.57 50.01 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 119.931 -0.708 . . . . 40.0 110.838 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.511 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.6 OUTLIER -145.28 148.47 33.5 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.243 -0.91 . . . . 40.0 109.693 -179.363 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -115.39 169.74 8.93 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.227 -0.92 . . . . 40.0 111.856 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -156.01 144.37 20.01 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.336 -0.616 . . . . 40.0 109.336 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.638 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -69.59 154.32 42.17 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.621 -0.674 . . . . 40.0 110.631 -178.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.402 HG13 ' HB ' ' A' ' 88' ' ' ILE . 16.9 mm -137.08 152.67 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.164 -0.96 . . . . 40.0 109.908 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.484 HD21 ' CG ' ' A' ' 86' ' ' ASP . 74.3 m-20 56.35 57.18 5.11 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.031 0.444 . . . . 40.0 111.492 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.466 ' CG ' ' N ' ' A' ' 79' ' ' THR . 65.1 t80 -120.85 153.66 36.83 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.257 -0.902 . . . . 40.0 109.317 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.551 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.2 p -132.55 -78.63 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.888 0.851 . . . . 40.0 109.602 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.551 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.44 102.17 2.72 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.855 -0.794 . . . . 40.0 108.855 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.48 -104.92 0.26 Allowed Glycine 0 N--CA 1.498 2.819 0 C-N-CA 119.557 -1.306 . . . . 40.0 109.961 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.1 t80 -126.59 -176.15 3.6 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.638 -0.919 . . . . 40.0 109.453 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.419 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.6 mtm180 -84.19 -150.69 0.12 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.379 -0.826 . . . . 40.0 110.212 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.404 HD22 ' HB2' ' A' ' 86' ' ' ASP . 41.9 p-10 -164.77 -134.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.567 -0.901 . . . . 40.0 108.567 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 26.5 p -115.66 -9.78 11.92 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.048 -1.033 . . . . 40.0 109.681 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.484 ' CG ' HD21 ' A' ' 77' ' ' ASN . 20.3 m-20 -75.17 108.76 8.13 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 120.798 0.332 . . . . 40.0 110.821 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.788 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.22 140.15 45.06 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.34 -0.944 . . . . 40.0 109.734 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.402 ' HB ' HG13 ' A' ' 76' ' ' ILE . 13.8 tt -109.75 148.48 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 CA-C-O 122.019 0.914 . . . . 40.0 110.137 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -124.18 129.15 50.32 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.768 -0.827 . . . . 40.0 108.768 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.501 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 5.6 p90 -132.53 140.94 48.53 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 109.658 -0.497 . . . . 40.0 109.658 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.519 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 71.5 p -107.54 -178.86 3.75 Favored 'General case' 0 N--CA 1.506 2.366 0 CA-C-O 122.292 1.044 . . . . 40.0 112.504 -177.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.729 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -55.5 -50.17 70.65 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 122.193 0.997 . . . . 40.0 109.216 177.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.567 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -68.07 1.07 2.99 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.022 -0.99 . . . . 40.0 109.536 -179.375 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.497 ' CZ2' ' CG ' ' A' ' 18' ' ' HIS . 77.2 m95 73.01 17.2 4.2 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 122.089 -0.382 . . . . 40.0 111.116 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 23.4 mt -70.39 125.45 26.85 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.146 -1.428 . . . . 40.0 107.146 177.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.462 HD11 ' CB ' ' A' ' 11' ' ' ALA . 2.6 mp -113.11 133.88 57.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 CA-C-O 122.767 1.27 . . . . 40.0 112.357 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.582 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.1 m-85 -126.75 158.83 35.48 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 107.985 -1.117 . . . . 40.0 107.985 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 4.8 ptmm? -127.71 142.18 51.4 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.218 -0.993 . . . . 40.0 112.983 -177.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.26 130.84 41.43 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.567 -1.272 . . . . 40.0 107.567 176.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.1 p -115.88 8.51 14.76 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 109.534 -0.543 . . . . 40.0 109.534 -178.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.558 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.74 31.62 6.4 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.845 -0.742 . . . . 40.0 110.016 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 65.22 67.27 0.52 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.104 -0.998 . . . . 40.0 111.04 178.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 61.04 43.0 11.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.409 -0.807 . . . . 40.0 110.398 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.558 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 26.6 mm-40 -116.65 -77.39 0.57 Allowed 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.57 -1.331 . . . . 40.0 109.603 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.496 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 20.4 p -94.61 122.41 37.18 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.98 -1.075 . . . . 40.0 110.096 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.572 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.1 m-85 -103.91 84.87 2.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.558 -0.713 . . . . 40.0 110.385 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.5 m -78.24 143.74 36.83 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.918 -1.114 . . . . 40.0 108.519 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.622 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 58.2 tttp -75.03 143.39 43.55 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.666 -0.646 . . . . 40.0 110.621 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.426 HD12 ' CG2' ' A' ' 96' ' ' ILE . 31.9 pt -124.29 -29.96 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.798 -0.815 . . . . 40.0 108.798 177.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.622 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.042 0 CA-C-O 118.719 -0.658 . . . . 40.0 109.304 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.683 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.2 t . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 109.145 -0.687 . . . . 40.0 109.145 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.553 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -139.06 147.61 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.336 -0.853 . . . . 40.0 109.433 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -147.22 33.35 0.89 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.335 -0.853 . . . . 40.0 110.349 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.6 p -117.79 142.17 47.59 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.571 0.701 . . . . 40.0 110.699 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -42.52 -85.64 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 CA-C-O 122.229 1.014 . . . . 40.0 113.392 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.641 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -45.84 -48.27 15.83 Favored 'General case' 0 C--N 1.285 -2.21 0 O-C-N 121.527 -0.733 . . . . 40.0 109.896 -179.952 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.6 -53.82 23.66 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 110.353 -1.099 . . . . 40.0 110.353 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.9 t -63.99 -44.24 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.349 -1.089 . . . . 40.0 109.725 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.97 -54.2 49.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.915 -1.116 . . . . 40.0 109.961 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -45.43 74.68 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.447 0.641 . . . . 40.0 109.505 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.625 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.7 t80 -56.74 -49.77 74.23 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.063 -1.088 . . . . 40.0 108.063 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.703 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.4 mt -68.29 -44.42 75.53 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.897 -0.721 . . . . 40.0 109.592 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.453 ' HG3' HD13 ' A' ' 96' ' ' ILE . 8.1 mt-30 -65.37 -24.1 67.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.715 -1.241 . . . . 40.0 111.154 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 m -99.9 -50.2 4.09 Favored 'General case' 0 N--CA 1.516 2.842 0 O-C-N 121.106 -0.997 . . . . 40.0 111.809 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.65 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.7 m-85 -98.95 -16.23 18.83 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 120.92 -1.112 . . . . 40.0 111.76 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.703 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.12 -19.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 121.395 0.617 . . . . 40.0 111.206 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.65 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -74.1 118.39 17.0 Favored 'General case' 0 C--N 1.291 -1.961 0 O-C-N 121.295 -0.878 . . . . 40.0 109.822 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.459 ' C ' ' O ' ' A' ' 19' ' ' LYS . 4.8 mt -43.84 128.14 4.17 Favored Pre-proline 0 N--CA 1.498 1.936 0 N-CA-C 107.505 -1.294 . . . . 40.0 107.505 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -36.46 134.0 0.33 Allowed 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.008 2.472 . . . . 40.0 112.575 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.627 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -63.76 78.21 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.6 -0.688 . . . . 40.0 110.254 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.683 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 168.24 16.27 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.468 -0.77 . . . . 40.0 110.399 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.417 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.8 m-85 -115.13 166.05 12.25 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 122.021 0.915 . . . . 40.0 110.944 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -155.7 151.25 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.186 -0.947 . . . . 40.0 109.022 178.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.506 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 80.5 p -70.58 154.43 41.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.34 -0.85 . . . . 40.0 110.241 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.613 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.59 -51.72 58.56 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.228 -1.397 . . . . 40.0 107.228 177.138 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.7 t -46.58 -62.94 1.15 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.615 -0.678 . . . . 40.0 110.064 178.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.506 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 35.4 mt-10 -47.62 -58.15 4.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.408 -0.807 . . . . 40.0 109.435 178.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.71 -50.3 63.63 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.493 -0.755 . . . . 40.0 109.526 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.16 -49.86 72.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.849 -0.532 . . . . 40.0 110.768 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.48 -29.62 68.29 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.23 -0.919 . . . . 40.0 110.467 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -17.02 64.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.767 -1.208 . . . . 40.0 109.079 178.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.518 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 128.12 1.18 6.31 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 120.376 -0.916 . . . . 40.0 111.434 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -64.25 115.56 5.15 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.469 -1.606 . . . . 40.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 51.8 t -122.97 143.29 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 121.355 -0.841 . . . . 40.0 110.401 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.84 -49.09 76.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.572 -0.705 . . . . 40.0 109.97 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 p -78.69 50.62 1.0 Allowed 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.698 -0.853 . . . . 40.0 108.698 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 tttp -172.83 -51.44 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.738 -0.838 . . . . 40.0 108.738 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.99 20.33 76.15 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 108.939 -1.665 . . . . 40.0 108.939 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.518 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 6.2 p-10 -55.73 128.08 33.1 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.987 -0.746 . . . . 40.0 108.987 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.478 ' O ' ' N ' ' A' ' 46' ' ' ALA . 5.1 tp -166.86 -56.65 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.917 0.865 . . . . 40.0 109.074 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.39 -28.57 59.65 Favored 'General case' 0 C--N 1.289 -2.039 0 O-C-N 121.14 -0.975 . . . . 40.0 110.384 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.5 -62.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.532 -0.73 . . . . 40.0 109.299 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 m -69.41 -29.66 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 CA-C-O 121.543 0.687 . . . . 40.0 109.977 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.524 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -142.93 78.55 15.35 Favored Pre-proline 0 C--N 1.299 -1.589 0 O-C-N 121.193 -0.942 . . . . 40.0 109.116 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -56.14 51.33 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 122.349 2.033 . . . . 40.0 114.685 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.25 0.06 OUTLIER Glycine 0 N--CA 1.502 3.087 0 C-N-CA 119.463 -1.351 . . . . 40.0 111.112 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 23.8 tttt -122.92 146.19 47.81 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.757 -1.437 . . . . 40.0 109.329 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.417 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 7.6 m -117.3 131.77 56.74 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.708 -1.245 . . . . 40.0 110.848 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 8.0 mm -60.27 149.14 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-O 121.63 0.728 . . . . 40.0 110.866 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.94 147.1 4.49 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.152 -1.499 . . . . 40.0 110.916 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 123.32 17.95 3.17 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.682 -0.77 . . . . 40.0 111.603 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.592 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -74.21 -169.56 0.81 Allowed 'General case' 0 C--O 1.195 -1.774 0 O-C-N 120.801 -1.411 . . . . 40.0 110.074 -179.331 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.19 139.13 50.01 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.801 0 CA-C-O 121.761 0.791 . . . . 40.0 110.2 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -150.3 147.79 28.06 Favored 'General case' 0 C--N 1.293 -1.882 0 C-N-CA 119.926 -0.71 . . . . 40.0 109.96 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.702 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -95.06 -16.66 22.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.818 -0.551 . . . . 40.0 110.03 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.51 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 67.1 t30 68.11 28.46 6.6 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 40.0 111.785 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.702 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.3 mtm-85 -56.78 -31.82 65.03 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.919 -1.113 . . . . 40.0 108.475 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.45 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 21.1 mp0 -61.85 -13.02 20.43 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.344 -0.613 . . . . 40.0 109.344 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.63 43.89 98.33 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.839 -1.304 . . . . 40.0 109.839 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.593 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -94.47 -12.36 27.86 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.476 -0.935 . . . . 40.0 108.476 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.51 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 31.9 mt -136.26 163.75 47.81 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 109.014 -0.736 . . . . 40.0 109.014 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.582 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 92.1 Cg_exo -43.26 137.61 5.06 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.987 1.791 . . . . 40.0 112.366 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.539 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.19 -169.5 12.51 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.065 -1.214 . . . . 40.0 110.065 -178.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.542 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.9 ptmm? 173.9 -158.81 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.138 -1.43 . . . . 40.0 107.138 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.4 p -73.33 88.51 1.55 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.034 -1.469 . . . . 40.0 107.034 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.542 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 74.79 103.98 0.09 OUTLIER Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.016 -1.634 . . . . 40.0 109.016 -177.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.608 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.0 tpp180 -125.41 143.06 51.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.942 -0.74 . . . . 40.0 109.467 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.763 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 35.2 p -109.78 133.24 53.37 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.832 -1.173 . . . . 40.0 107.832 178.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.591 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 32.7 m95 -127.17 141.37 51.76 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.815 0.817 . . . . 40.0 110.474 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.56 HH12 ' HA ' ' A' ' 92' ' ' SER . 1.0 OUTLIER -144.89 146.67 32.13 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.54 -0.725 . . . . 40.0 109.378 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.613 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -113.93 172.97 6.66 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.154 -0.966 . . . . 40.0 112.354 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -159.22 143.7 15.42 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.766 -0.584 . . . . 40.0 109.734 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.614 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.69 156.37 35.45 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.471 -0.768 . . . . 40.0 110.617 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.433 HG13 ' HB ' ' A' ' 88' ' ' ILE . 13.8 mm -139.69 152.13 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 40.0 109.463 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.485 HD21 ' CG ' ' A' ' 86' ' ' ASP . 70.7 m-20 56.29 54.93 7.15 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.117 -0.492 . . . . 40.0 111.616 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.478 ' CG ' ' N ' ' A' ' 79' ' ' THR . 52.7 t80 -116.72 155.49 28.78 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.997 -1.065 . . . . 40.0 108.968 177.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.557 ' OG1' ' N ' ' A' ' 80' ' ' SER . 32.9 p -132.84 -78.08 0.49 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.82 0.819 . . . . 40.0 109.904 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.557 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.0 OUTLIER -152.47 102.73 2.76 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.155 -1.054 . . . . 40.0 108.155 -179.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 151.87 -108.16 0.36 Allowed Glycine 0 N--CA 1.501 3.022 0 N-CA-C 109.762 -1.335 . . . . 40.0 109.762 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . 0.487 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 20.1 t80 -124.67 -178.06 4.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.304 -1.115 . . . . 40.0 109.357 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.487 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 1.3 mtm180 -83.44 -151.49 0.11 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.795 0.807 . . . . 40.0 110.806 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 40.5 p30 -164.6 -133.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.782 -0.822 . . . . 40.0 108.782 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.5 p -116.08 -9.88 11.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.033 -1.042 . . . . 40.0 110.249 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.485 ' CG ' HD21 ' A' ' 77' ' ' ASN . 17.9 m-20 -74.65 110.9 9.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 122.172 -0.33 . . . . 40.0 110.595 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.782 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -137.15 140.14 41.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.237 -0.914 . . . . 40.0 109.83 179.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.433 ' HB ' HG13 ' A' ' 76' ' ' ILE . 11.1 tt -110.35 148.79 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 122.389 1.09 . . . . 40.0 110.205 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' A' ' 96' ' ' ILE . 2.2 mm? -125.62 128.01 47.2 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.663 -0.648 . . . . 40.0 109.323 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.503 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.46 142.61 50.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.479 -0.763 . . . . 40.0 109.249 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.591 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 90.0 p -107.34 178.51 4.52 Favored 'General case' 0 N--CA 1.504 2.241 0 CA-C-O 122.128 0.966 . . . . 40.0 112.679 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.763 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.42 -51.86 56.91 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-O 122.176 0.988 . . . . 40.0 109.059 177.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.608 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.03 5.24 1.22 Allowed 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 114.87 -1.059 . . . . 40.0 109.742 -179.002 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.479 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 77.1 m95 69.53 19.69 7.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 122.05 -0.406 . . . . 40.0 111.608 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 21.7 mt -72.87 127.61 33.05 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.285 -1.746 . . . . 40.0 106.285 177.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.453 HD13 ' HG3' ' A' ' 15' ' ' GLN . 2.4 mp -112.97 135.99 50.67 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.103 0 CA-C-O 122.914 1.34 . . . . 40.0 111.751 -177.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.635 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.9 m-85 -127.72 158.08 38.59 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 107.75 -1.204 . . . . 40.0 107.75 178.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.429 ' HD2' ' CG2' ' A' ' 109' ' ' ILE . 6.0 ptmm? -127.08 142.64 51.47 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.056 -1.027 . . . . 40.0 112.124 -178.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.48 HG22 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.86 129.89 37.08 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.973 -1.491 . . . . 40.0 106.973 178.151 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.4 p -117.07 9.07 13.51 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 109.506 -0.553 . . . . 40.0 109.506 -177.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.543 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.97 33.4 5.25 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.584 -0.846 . . . . 40.0 109.772 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 64.58 66.27 0.6 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.042 -1.036 . . . . 40.0 110.826 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 60.7 42.74 13.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.479 -0.763 . . . . 40.0 110.408 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.543 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.2 mm-40 -115.53 -77.64 0.57 Allowed 'General case' 0 N--CA 1.509 2.49 0 O-C-N 120.701 -1.249 . . . . 40.0 109.551 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.514 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 19.7 p -93.03 121.1 34.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.606 -1.309 . . . . 40.0 110.177 -178.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.593 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 6.7 m-85 -102.33 83.7 2.36 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.644 -0.66 . . . . 40.0 110.911 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.1 m -76.35 144.35 40.18 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 122.106 0.955 . . . . 40.0 109.344 177.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.696 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 57.8 tttp -76.8 146.13 38.04 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 121.496 -0.753 . . . . 40.0 110.031 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.429 ' CG2' ' HD2' ' A' ' 98' ' ' LYS . 31.8 pt -127.61 -31.54 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 120.049 -0.66 . . . . 40.0 109.305 178.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.696 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.501 2.121 0 N-CA-C 108.817 -0.809 . . . . 40.0 108.817 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.643 ' N ' ' O ' ' A' ' 22' ' ' ASP . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.542 -0.54 . . . . 40.0 109.542 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.581 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.12 146.49 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.648 -0.658 . . . . 40.0 109.463 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -148.67 32.69 0.78 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.114 -0.991 . . . . 40.0 109.305 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.0 p -119.54 141.56 49.12 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.502 -0.879 . . . . 40.0 110.58 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -41.84 -87.37 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 N-CA-C 113.486 0.921 . . . . 40.0 113.486 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.641 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -47.57 -46.16 27.75 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.316 -0.865 . . . . 40.0 109.878 -179.494 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.87 47.95 Favored Glycine 0 N--CA 1.497 2.708 0 N-CA-C 110.043 -1.223 . . . . 40.0 110.043 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.44 -43.88 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.124 -1.221 . . . . 40.0 109.368 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.433 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -57.2 -54.6 44.96 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.557 0.694 . . . . 40.0 109.785 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -49.18 67.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.558 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.1 t80 -51.81 -51.31 57.39 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.952 0.882 . . . . 40.0 109.309 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 66.0 mt -70.04 -45.77 66.46 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.725 -0.61 . . . . 40.0 111.463 -179.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -62.64 -24.2 67.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.853 -1.154 . . . . 40.0 110.568 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.5 m -101.66 -49.22 4.06 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 120.481 -1.387 . . . . 40.0 111.182 -178.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.585 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.4 m-85 -101.64 -14.05 17.57 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.525 -0.735 . . . . 40.0 110.784 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.536 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.8 m-70 61.78 -25.72 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.096 -1.002 . . . . 40.0 111.788 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.588 ' NZ ' ' OD2' ' A' ' 22' ' ' ASP . 0.4 OUTLIER -73.8 123.76 24.78 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.518 -1.364 . . . . 40.0 109.847 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.65 128.86 13.9 Favored Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.426 -0.796 . . . . 40.0 109.339 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -37.62 131.28 0.72 Allowed 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.411 2.074 . . . . 40.0 112.08 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -63.34 78.4 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.838 0.828 . . . . 40.0 110.11 -179.108 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.643 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 170.26 14.44 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.861 -0.524 . . . . 40.0 110.759 -179.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.432 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.9 m-85 -114.17 164.82 13.36 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.84 0.829 . . . . 40.0 111.834 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.79 150.28 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.345 -0.847 . . . . 40.0 109.695 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.608 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 68.2 p -73.07 150.54 42.23 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.227 -0.92 . . . . 40.0 108.708 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.588 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -48.29 -53.09 18.52 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.802 -1.185 . . . . 40.0 107.802 178.321 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.0 t -46.33 -62.2 1.46 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.445 -0.784 . . . . 40.0 110.714 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.608 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 36.1 mt-10 -50.73 -56.07 13.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.874 -1.141 . . . . 40.0 109.009 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.83 -51.07 59.26 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.264 -0.898 . . . . 40.0 109.768 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.79 -48.35 77.23 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.844 -0.535 . . . . 40.0 110.829 -179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -30.67 69.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.368 -0.833 . . . . 40.0 110.467 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.67 -18.49 64.28 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.17 -0.956 . . . . 40.0 108.759 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.516 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 130.6 -0.7 5.52 Favored Glycine 0 N--CA 1.503 3.157 0 C-N-CA 120.192 -1.004 . . . . 40.0 111.02 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -62.84 113.29 2.96 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.544 -1.563 . . . . 40.0 109.074 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -122.09 141.86 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.344 -0.847 . . . . 40.0 111.032 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.13 -47.32 86.78 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.18 -0.95 . . . . 40.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.5 p -78.52 49.95 0.91 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.735 -1.228 . . . . 40.0 109.258 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -174.27 -49.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.204 -0.665 . . . . 40.0 109.204 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.02 24.42 73.15 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.194 -1.562 . . . . 40.0 109.194 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.516 HD22 ' C ' ' A' ' 34' ' ' GLY . 4.7 p-10 -57.18 130.17 45.0 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.762 -0.846 . . . . 40.0 108.803 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.425 HD22 ' CE2' ' A' ' 78' ' ' TYR . 6.2 tp -169.34 -56.81 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.932 -0.766 . . . . 40.0 108.932 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.46 -27.18 35.69 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.751 -1.218 . . . . 40.0 109.803 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.42 -66.14 0.81 Allowed 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.583 0.706 . . . . 40.0 109.629 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.0 m -69.06 -27.13 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.475 -0.766 . . . . 40.0 110.615 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.469 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -143.82 78.35 14.22 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.936 . . . . 40.0 108.494 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -59.42 54.15 0.07 OUTLIER 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 123.409 2.74 . . . . 40.0 113.644 -178.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.34 40.85 0.07 OUTLIER Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.505 -1.331 . . . . 40.0 110.39 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -120.72 148.66 43.65 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.265 -1.138 . . . . 40.0 110.403 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 4.4 m -120.86 132.0 54.73 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.115 -0.991 . . . . 40.0 110.726 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.46 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 1.7 mm -65.05 155.43 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 CA-C-O 122.55 1.167 . . . . 40.0 111.015 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.495 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.84 154.4 6.4 Favored Glycine 0 N--CA 1.483 1.798 0 N-CA-C 109.15 -1.58 . . . . 40.0 109.15 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 117.44 18.15 5.43 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 119.859 -1.162 . . . . 40.0 111.111 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.54 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -76.58 -170.13 1.44 Allowed 'General case' 0 C--O 1.192 -1.923 0 O-C-N 120.607 -1.525 . . . . 40.0 109.758 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.0 mm -132.84 138.25 52.21 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.024 0 CA-C-O 121.798 0.809 . . . . 40.0 110.257 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -149.92 149.0 29.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.757 -0.589 . . . . 40.0 110.021 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.694 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.59 -17.93 21.86 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.806 -0.559 . . . . 40.0 110.318 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.432 HD22 ' H ' ' A' ' 63' ' ' LEU . 65.9 t30 66.59 27.07 9.68 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.127 -0.983 . . . . 40.0 111.666 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.694 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.0 OUTLIER -55.37 -31.61 61.92 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.2 -1.037 . . . . 40.0 108.2 178.096 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.435 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 21.6 mp0 -64.69 -8.37 14.33 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 108.999 -0.741 . . . . 40.0 108.999 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.15 43.76 98.05 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 110.28 -1.128 . . . . 40.0 110.28 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.569 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -91.8 -13.64 31.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.38 -1.07 . . . . 40.0 109.074 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.432 ' H ' HD22 ' A' ' 58' ' ' ASN . 25.0 mt -135.25 167.43 22.61 Favored Pre-proline 0 N--CA 1.499 1.991 0 N-CA-C 108.299 -1.0 . . . . 40.0 108.299 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.65 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 88.1 Cg_exo -47.21 141.95 12.59 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.595 1.53 . . . . 40.0 112.344 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.649 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.95 -166.9 11.58 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 110.448 -1.061 . . . . 40.0 110.448 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.561 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.8 pttm 172.96 -156.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 106.807 -1.553 . . . . 40.0 106.807 -178.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 57.0 p -75.42 86.44 2.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.656 -1.278 . . . . 40.0 107.901 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.561 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.15 99.19 0.31 Allowed Glycine 0 N--CA 1.498 2.802 0 N-CA-C 108.665 -1.774 . . . . 40.0 108.665 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.649 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 17.0 tpp180 -122.56 140.12 53.14 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.349 -1.089 . . . . 40.0 109.878 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.764 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 31.4 p -107.26 131.32 54.33 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 108.212 -1.033 . . . . 40.0 108.212 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.65 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.3 m95 -126.0 141.57 51.9 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.761 -0.776 . . . . 40.0 110.846 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.61 ' HB2' ' CZ ' ' A' ' 90' ' ' TYR . 0.4 OUTLIER -143.8 148.74 36.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.196 -0.94 . . . . 40.0 109.306 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.588 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -113.71 175.48 5.44 Favored 'General case' 0 C--N 1.31 -1.125 0 O-C-N 120.983 -1.073 . . . . 40.0 113.14 -178.715 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.495 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -161.44 139.29 9.18 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.654 -0.654 . . . . 40.0 110.584 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.632 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.17 154.42 39.81 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.5 -0.75 . . . . 40.0 110.232 -179.562 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.43 HG13 ' HB ' ' A' ' 88' ' ' ILE . 18.3 mm -138.11 152.61 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.174 -0.954 . . . . 40.0 109.381 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.493 HD21 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 56.64 56.29 5.68 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.04 0.447 . . . . 40.0 111.505 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.478 ' CG ' ' N ' ' A' ' 79' ' ' THR . 65.9 t80 -120.51 154.51 35.2 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.936 -1.102 . . . . 40.0 109.129 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.602 ' OG1' ' N ' ' A' ' 80' ' ' SER . 43.5 p -133.32 -79.49 0.48 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 122.036 0.922 . . . . 40.0 109.49 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.602 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.84 103.55 2.78 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 115.314 -0.857 . . . . 40.0 110.027 -179.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.79 -104.58 0.26 Allowed Glycine 0 N--CA 1.501 2.983 0 N-CA-C 108.713 -1.755 . . . . 40.0 108.713 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 15.3 t80 -125.93 -175.46 3.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.534 -0.98 . . . . 40.0 109.429 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.443 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.5 mtm180 -83.68 -149.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.804 . . . . 40.0 109.728 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 38.4 p30 -165.02 -134.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.108 -1.071 . . . . 40.0 108.108 179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 29.9 p -116.0 -9.18 11.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.773 -1.204 . . . . 40.0 109.978 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.493 ' CG ' HD21 ' A' ' 77' ' ' ASN . 23.9 m-20 -74.33 108.77 7.32 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 122.195 -0.316 . . . . 40.0 110.558 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.789 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.07 137.07 42.52 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.114 -0.991 . . . . 40.0 110.422 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.43 ' HB ' HG13 ' A' ' 76' ' ' ILE . 14.6 tt -106.98 146.51 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 CA-C-O 122.108 0.956 . . . . 40.0 110.858 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.411 ' O ' ' HA ' ' A' ' 96' ' ' ILE . 1.8 mm? -124.32 129.78 51.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 40.0 108.808 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.61 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 21.8 p90 -132.65 142.03 48.91 Favored 'General case' 0 N--CA 1.515 2.792 0 N-CA-C 109.528 -0.545 . . . . 40.0 109.528 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.567 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.8 p -108.07 -178.71 3.69 Favored 'General case' 0 N--CA 1.506 2.349 0 CA-C-O 122.248 1.023 . . . . 40.0 113.109 -176.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.764 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.12 -52.66 57.96 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.502 1.144 . . . . 40.0 108.45 178.31 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.554 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -67.67 3.72 1.32 Allowed 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.348 -1.297 . . . . 40.0 110.116 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.498 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 73.2 m95 71.55 15.48 6.07 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.823 -0.548 . . . . 40.0 111.789 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 21.0 mt -69.38 127.39 32.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.26 -1.525 . . . . 40.0 106.916 178.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.459 HG21 HD12 ' A' ' 109' ' ' ILE . 2.5 mp -113.13 135.33 52.98 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 CA-C-O 122.824 1.297 . . . . 40.0 111.347 -177.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.546 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 14.0 m-85 -127.33 159.8 33.3 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.938 -1.504 . . . . 40.0 106.938 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.446 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 4.5 ptmm? -128.45 142.8 50.98 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 119.028 -1.069 . . . . 40.0 112.731 -178.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 131.77 40.84 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 107.616 -1.253 . . . . 40.0 107.616 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.7 p -116.82 9.52 13.92 Favored 'General case' 0 N--CA 1.51 2.551 0 N-CA-C 109.699 -0.482 . . . . 40.0 109.699 -177.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.585 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -114.72 36.2 3.93 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.496 -0.882 . . . . 40.0 109.341 179.196 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.69 69.32 0.69 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.15 -0.968 . . . . 40.0 110.977 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 58.92 45.87 14.54 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.449 -0.782 . . . . 40.0 110.445 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.585 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 31.5 mm-40 -118.82 -78.73 0.59 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.742 -1.224 . . . . 40.0 109.083 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.492 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.0 p -93.84 121.95 35.82 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 120.849 -1.157 . . . . 40.0 110.183 -178.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.569 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -102.91 84.15 2.33 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.571 -0.706 . . . . 40.0 110.881 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.4 m -77.77 142.29 38.75 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.822 -1.174 . . . . 40.0 108.977 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.64 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 60.7 tttp -75.08 144.93 42.71 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.856 -0.528 . . . . 40.0 110.705 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.459 HD12 HG21 ' A' ' 96' ' ' ILE . 26.9 pt -127.49 -28.86 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 109.166 -0.679 . . . . 40.0 109.166 177.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.641 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.066 0 N-CA-C 108.861 -0.792 . . . . 40.0 108.861 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.674 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.0 t . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.347 -0.612 . . . . 40.0 109.347 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.596 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.7 mt -139.01 146.06 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.373 -0.83 . . . . 40.0 109.709 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.9 p-10 -147.52 32.88 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.089 -1.007 . . . . 40.0 109.765 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -118.87 140.94 49.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.949 0.88 . . . . 40.0 110.287 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -41.17 -85.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 113.033 0.753 . . . . 40.0 113.033 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.634 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -48.37 -45.66 35.94 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.744 -0.598 . . . . 40.0 109.851 -178.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.74 -52.11 31.01 Favored Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.495 -1.042 . . . . 40.0 110.495 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 51.3 t -65.77 -45.08 92.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -1.211 . . . . 40.0 109.726 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.453 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -58.06 -56.98 15.03 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.626 0.727 . . . . 40.0 110.168 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.49 -49.58 67.19 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.965 -0.754 . . . . 40.0 108.965 178.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.657 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 16.6 t80 -51.85 -50.85 60.12 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.179 0.99 . . . . 40.0 109.02 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.559 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 29.3 mt -66.37 -47.16 74.29 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 115.918 -0.583 . . . . 40.0 110.713 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -64.13 -21.67 66.64 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.196 -0.94 . . . . 40.0 111.531 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.2 m -105.11 -46.02 4.36 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.875 -1.14 . . . . 40.0 111.811 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.609 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.5 m-85 -100.37 -17.12 17.38 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.145 -0.972 . . . . 40.0 110.919 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.5 m-70 61.97 -29.02 0.07 Allowed 'General case' 0 N--CA 1.505 2.3 0 CA-C-O 121.668 0.746 . . . . 40.0 111.282 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.657 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.47 115.96 12.36 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 120.93 -1.106 . . . . 40.0 108.741 179.503 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.411 ' C ' ' O ' ' A' ' 19' ' ' LYS . 0.9 OUTLIER -42.9 129.92 3.16 Favored Pre-proline 0 N--CA 1.5 2.029 0 N-CA-C 108.846 -0.798 . . . . 40.0 108.846 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.439 ' O ' ' N ' ' A' ' 23' ' ' ASN . 74.2 Cg_exo -35.47 134.82 0.21 Allowed 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.741 2.294 . . . . 40.0 112.94 -179.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.59 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -64.32 73.86 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 121.862 0.839 . . . . 40.0 110.302 -179.011 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.674 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 172.19 16.34 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.606 -0.684 . . . . 40.0 111.367 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -113.57 164.64 13.39 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.311 -0.868 . . . . 40.0 111.034 -178.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -153.91 149.94 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.333 -0.855 . . . . 40.0 109.562 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.546 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 67.2 p -70.6 151.38 45.06 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.671 -0.643 . . . . 40.0 109.509 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.641 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -50.58 -51.76 45.35 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 107.715 -1.217 . . . . 40.0 107.715 177.226 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -47.14 -61.85 1.69 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.614 -0.679 . . . . 40.0 110.473 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.546 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 34.9 mt-10 -49.76 -57.13 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.089 -1.007 . . . . 40.0 108.939 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.93 58.9 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-O 121.632 0.73 . . . . 40.0 109.656 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -64.34 -48.22 76.37 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.829 -0.544 . . . . 40.0 110.985 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.32 -31.08 70.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.259 -0.901 . . . . 40.0 109.957 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.8 -20.11 65.88 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.187 -0.945 . . . . 40.0 108.951 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.534 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 130.99 -1.89 5.5 Favored Glycine 0 N--CA 1.501 2.986 0 N-CA-C 110.863 -0.895 . . . . 40.0 110.863 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -60.07 116.52 4.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.585 -1.538 . . . . 40.0 109.034 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 43.2 t -123.88 143.7 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 CA-C-O 121.735 0.778 . . . . 40.0 110.523 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.8 77.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.244 -0.91 . . . . 40.0 109.812 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.9 p -79.16 51.08 1.13 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.86 -1.15 . . . . 40.0 109.06 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -173.3 -50.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 108.924 -0.769 . . . . 40.0 108.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.39 21.68 72.51 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 108.805 -1.718 . . . . 40.0 108.805 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.534 HD22 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -56.79 132.02 51.04 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.85 -0.794 . . . . 40.0 109.059 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 46' ' ' ALA . 6.1 tp -169.97 -57.2 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.995 -1.113 . . . . 40.0 107.995 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.22 -23.75 49.96 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.683 -0.636 . . . . 40.0 110.768 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.432 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -76.86 -64.41 1.13 Allowed 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.709 -0.849 . . . . 40.0 108.709 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.5 m -68.87 -27.05 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . -144.62 79.69 12.22 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.571 -0.705 . . . . 40.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -59.26 55.88 0.06 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.713 2.275 . . . . 40.0 114.105 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.95 43.83 0.06 OUTLIER Glycine 0 N--CA 1.502 3.039 0 C-N-CA 120.104 -1.046 . . . . 40.0 111.152 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 19.2 tttt -122.89 146.18 47.8 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.771 -1.429 . . . . 40.0 109.585 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.6 m -116.21 136.97 52.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 40.0 109.808 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 7.4 mm -66.49 151.86 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 CA-C-O 121.241 0.543 . . . . 40.0 109.606 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.41 145.72 4.18 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 118.924 -1.607 . . . . 40.0 110.88 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.77 15.86 3.13 Favored Glycine 0 N--CA 1.494 2.56 0 O-C-N 121.305 -1.115 . . . . 40.0 111.388 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.591 ' OD2' ' NZ ' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -72.11 -169.65 0.52 Allowed 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.151 -1.205 . . . . 40.0 110.356 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.1 mm -133.49 138.14 51.61 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.62 0 CA-C-O 121.459 0.647 . . . . 40.0 109.627 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -150.41 146.84 26.93 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.426 -0.796 . . . . 40.0 109.63 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.686 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -91.16 -21.83 20.97 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.691 -0.631 . . . . 40.0 110.174 179.737 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 64.6 t30 72.33 26.69 2.62 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.265 -0.897 . . . . 40.0 111.588 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.686 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.2 mtm-85 -55.32 -31.86 62.01 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.969 -1.082 . . . . 40.0 108.461 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.432 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.2 mp0 -62.9 -10.48 13.58 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.063 -0.717 . . . . 40.0 109.063 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.27 45.42 96.51 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 110.402 -1.079 . . . . 40.0 110.402 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.589 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -95.28 -13.21 25.04 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.579 -0.953 . . . . 40.0 109.741 -179.785 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.493 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 24.7 mt -136.77 163.72 47.56 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.15 -1.056 . . . . 40.0 108.15 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.496 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 91.5 Cg_exo -42.62 141.59 2.31 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 122.449 2.099 . . . . 40.0 112.814 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.468 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.97 -171.02 12.71 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 110.788 -0.925 . . . . 40.0 110.788 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.615 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 ptmm? 177.09 -157.77 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.213 -1.403 . . . . 40.0 107.213 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.1 p -75.08 84.91 2.32 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 107.134 -1.432 . . . . 40.0 107.134 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.615 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.91 99.33 0.35 Allowed Glycine 0 N--CA 1.497 2.726 0 N-CA-C 108.954 -1.658 . . . . 40.0 108.954 -178.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.604 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.1 tpp180 -121.14 142.68 49.64 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.587 -0.949 . . . . 40.0 110.175 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.747 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.99 128.66 55.14 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.341 -0.985 . . . . 40.0 108.341 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.52 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 34.5 m95 -120.54 142.3 49.46 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.062 -1.024 . . . . 40.0 110.814 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.564 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.2 mpp_? -141.22 146.89 37.47 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.462 -0.773 . . . . 40.0 109.986 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.641 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -116.72 169.84 9.05 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 121.184 -0.948 . . . . 40.0 111.983 -179.87 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -157.49 145.31 18.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.561 -0.712 . . . . 40.0 109.747 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.64 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.24 154.63 41.69 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.524 -0.735 . . . . 40.0 109.474 -178.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.423 HG13 ' HB ' ' A' ' 88' ' ' ILE . 15.0 mm -137.34 149.9 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.103 -0.998 . . . . 40.0 109.653 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.45 HD21 ' CG ' ' A' ' 86' ' ' ASP . 76.6 m-20 59.69 57.11 3.32 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.144 0.497 . . . . 40.0 111.016 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.468 ' CG ' ' N ' ' A' ' 79' ' ' THR . 60.6 t80 -121.51 153.83 37.44 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.17 -0.956 . . . . 40.0 109.025 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.0 p -132.29 -79.81 0.5 Allowed 'General case' 0 N--CA 1.5 2.03 0 CA-C-O 121.833 0.825 . . . . 40.0 109.937 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.99 99.92 2.59 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 108.723 -0.843 . . . . 40.0 108.723 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.17 -107.71 0.34 Allowed Glycine 0 N--CA 1.496 2.655 0 N-CA-C 109.953 -1.259 . . . . 40.0 109.953 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.471 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 19.5 t80 -123.43 -178.98 4.16 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.343 -1.093 . . . . 40.0 110.299 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.471 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -83.28 -153.45 0.13 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.744 0.783 . . . . 40.0 110.306 -179.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -162.92 -133.66 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.356 -0.979 . . . . 40.0 108.356 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.9 p -115.39 -10.35 12.01 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.997 -1.064 . . . . 40.0 109.706 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.45 ' CG ' HD21 ' A' ' 77' ' ' ASN . 14.1 m-20 -72.57 108.3 5.54 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 120.834 0.35 . . . . 40.0 110.078 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.757 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.02 137.61 41.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.124 -1.03 . . . . 40.0 110.502 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.444 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.6 tt -107.99 148.01 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 122.509 1.147 . . . . 40.0 110.896 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.444 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -125.48 127.3 46.27 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.704 -0.85 . . . . 40.0 108.704 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.564 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.9 p90 -131.48 141.38 49.76 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.682 -0.858 . . . . 40.0 108.682 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.52 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 61.7 p -107.3 178.73 4.46 Favored 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 122.114 0.959 . . . . 40.0 112.155 -177.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.747 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -50.7 -54.04 26.41 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.37 1.081 . . . . 40.0 108.526 177.381 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.604 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -66.02 3.56 0.82 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.694 -1.139 . . . . 40.0 110.389 -179.153 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.453 ' H ' ' C ' ' A' ' 92' ' ' SER . 64.9 m95 72.44 13.35 5.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.711 -0.618 . . . . 40.0 111.935 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.47 127.16 31.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 119.896 -1.752 . . . . 40.0 107.428 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.453 HD11 ' CB ' ' A' ' 11' ' ' ALA . 2.5 mt -114.24 132.8 62.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-O 122.552 1.168 . . . . 40.0 112.529 -177.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.495 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.4 m-85 -125.26 157.08 37.49 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 114.335 -1.302 . . . . 40.0 107.564 178.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.6 ptmm? -128.03 141.54 51.48 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.027 -1.069 . . . . 40.0 112.36 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 105' ' ' THR . 0.0 OUTLIER -131.1 132.66 44.99 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 107.128 -1.434 . . . . 40.0 107.128 177.248 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.8 p -117.89 9.3 12.83 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 109.449 -0.574 . . . . 40.0 109.449 -178.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.51 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.63 35.11 4.19 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 119.672 -0.811 . . . . 40.0 109.765 179.16 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.13 68.05 0.76 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.21 -0.931 . . . . 40.0 111.036 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 60.53 42.57 14.04 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.793 -0.567 . . . . 40.0 110.778 178.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.51 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.9 mm-40 -114.63 -76.95 0.57 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.732 -1.23 . . . . 40.0 109.655 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.456 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.0 p -93.83 126.03 38.79 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.622 -1.299 . . . . 40.0 110.669 -178.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.589 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.8 m-85 -105.85 85.98 2.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.593 -0.692 . . . . 40.0 110.807 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.5 m -77.89 144.87 36.57 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.25 -0.98 . . . . 40.0 108.793 177.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.682 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 58.8 tttp -77.21 147.92 36.15 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.609 -0.682 . . . . 40.0 110.151 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.451 ' O ' ' HG2' ' A' ' 110' ' ' ARG . 23.2 pt -127.21 -35.46 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 N-CA-C 108.443 -0.947 . . . . 40.0 108.443 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.682 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.11 0 O-C-N 121.565 -0.709 . . . . 40.0 109.576 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.652 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.3 t . . . . . 0 N--CA 1.494 1.765 0 N-CA-C 109.132 -0.692 . . . . 40.0 109.132 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.562 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 9.5 mt -135.78 147.22 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.473 -0.767 . . . . 40.0 109.599 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -147.73 29.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.99 -1.068 . . . . 40.0 109.734 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.4 p -116.48 143.05 46.07 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 119.68 -0.808 . . . . 40.0 110.732 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -42.95 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.372 0 N-CA-C 112.781 0.66 . . . . 40.0 112.781 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.608 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.0 OUTLIER -47.59 -47.23 28.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.583 -0.698 . . . . 40.0 110.135 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.24 -50.91 38.4 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.52 -1.032 . . . . 40.0 110.52 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.2 t -65.58 -46.38 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.097 -1.237 . . . . 40.0 109.426 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.502 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -56.71 -57.1 13.88 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.417 -0.802 . . . . 40.0 110.246 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.08 -51.36 58.13 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 108.904 -0.776 . . . . 40.0 108.904 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.644 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.0 t80 -51.12 -49.93 59.82 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.969 0.89 . . . . 40.0 109.781 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.607 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 34.7 mt -68.25 -45.5 73.03 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.623 -0.673 . . . . 40.0 110.118 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -65.27 -19.12 65.82 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.387 -0.925 . . . . 40.0 111.744 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.9 m -107.52 -44.01 4.39 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.766 -1.209 . . . . 40.0 110.821 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.595 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.9 m-85 -104.52 -14.44 15.67 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 40.0 111.615 -177.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.607 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.3 m-70 59.54 -33.44 0.06 Allowed 'General case' 0 N--CA 1.51 2.549 0 CA-C-O 121.288 0.566 . . . . 40.0 111.483 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.644 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -68.68 120.85 15.32 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.758 -1.214 . . . . 40.0 108.233 179.481 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.474 ' HA ' HD23 ' A' ' 14' ' ' LEU . 3.4 mt -48.13 133.02 12.34 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.335 -0.853 . . . . 40.0 109.398 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.458 ' O ' ' N ' ' A' ' 23' ' ' ASN . 78.7 Cg_exo -35.82 132.36 0.29 Allowed 'Trans proline' 0 C--N 1.313 -1.341 0 C-N-CA 122.732 2.288 . . . . 40.0 112.889 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.557 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.3 OUTLIER -63.48 74.8 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.955 0.883 . . . . 40.0 109.732 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.652 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 172.42 15.68 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.655 -0.653 . . . . 40.0 110.577 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -114.93 162.94 16.26 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.747 0.784 . . . . 40.0 111.095 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -149.38 151.4 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.086 -1.009 . . . . 40.0 109.698 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.605 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 77.7 p -71.57 149.64 45.48 Favored 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 109.049 -0.723 . . . . 40.0 109.049 177.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.65 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -48.77 -53.67 18.14 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.196 -1.039 . . . . 40.0 108.196 177.812 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.2 t -45.58 -63.19 1.01 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.739 -0.6 . . . . 40.0 110.415 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.605 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 44.5 mt-10 -49.42 -57.12 7.52 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.54 -0.725 . . . . 40.0 109.357 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.01 -48.49 70.38 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.324 -0.86 . . . . 40.0 109.91 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.408 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 57.0 mt-30 -64.43 -48.74 74.18 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 40.0 110.192 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.18 70.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 40.0 110.46 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.68 -20.35 66.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.288 -0.883 . . . . 40.0 109.209 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.521 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 132.73 -4.04 5.04 Favored Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.942 -1.123 . . . . 40.0 111.106 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -61.2 114.39 3.12 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.709 -1.465 . . . . 40.0 109.098 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.7 t -121.93 143.0 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-O 121.799 0.809 . . . . 40.0 110.626 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.08 -47.58 84.03 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.642 -0.661 . . . . 40.0 110.243 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.2 p -79.13 50.15 1.02 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.064 -1.022 . . . . 40.0 108.997 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -174.25 -51.55 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.115 -0.698 . . . . 40.0 109.115 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.63 23.76 75.4 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.521 HD22 ' C ' ' A' ' 34' ' ' GLY . 4.1 p-10 -56.51 130.11 43.64 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.838 -0.801 . . . . 40.0 108.967 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 46' ' ' ALA . 5.4 tp -168.26 -60.05 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.997 -0.742 . . . . 40.0 108.997 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.32 -23.64 38.44 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.312 -0.868 . . . . 40.0 109.808 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -65.06 0.98 Allowed 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.916 -0.772 . . . . 40.0 108.916 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.49 -26.76 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-O 121.468 0.652 . . . . 40.0 109.553 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -144.65 78.64 12.88 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.32 -0.862 . . . . 40.0 109.873 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -57.49 52.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.497 1.728 0 C-N-CA 122.847 2.364 . . . . 40.0 114.238 -178.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.34 42.92 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 C-N-CA 119.565 -1.302 . . . . 40.0 111.262 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -121.71 144.5 48.75 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.26 . . . . 40.0 109.996 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.0 m -116.25 132.18 56.74 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.177 -0.952 . . . . 40.0 109.941 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.8 mm -63.89 150.86 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.342 -0.849 . . . . 40.0 110.099 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.77 151.61 5.73 Favored Glycine 0 N--CA 1.502 3.048 0 C-N-CA 119.798 -1.191 . . . . 40.0 110.472 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 118.82 18.2 4.83 Favored Glycine 0 N--CA 1.497 2.709 0 O-C-N 121.177 -1.19 . . . . 40.0 110.865 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.65 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -75.78 -169.93 1.2 Allowed 'General case' 0 C--O 1.191 -1.987 0 O-C-N 121.182 -1.187 . . . . 40.0 109.537 179.768 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.8 mm -133.81 142.1 42.29 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.906 0 CA-C-O 121.726 0.774 . . . . 40.0 109.945 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -154.51 146.85 23.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.696 -0.627 . . . . 40.0 109.53 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.685 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -93.39 -19.38 21.37 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.431 -0.793 . . . . 40.0 110.874 -179.762 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.505 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.8 t30 69.15 30.14 4.45 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.115 -0.99 . . . . 40.0 111.825 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.685 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.86 -31.69 65.07 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.966 -1.084 . . . . 40.0 108.43 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.456 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.0 mp0 -63.47 -11.54 24.51 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 63.24 41.23 99.64 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.153 -1.179 . . . . 40.0 110.153 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.589 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -91.6 -13.81 31.3 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.446 -1.032 . . . . 40.0 109.157 179.706 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.505 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 30.8 mt -135.72 163.37 51.01 Favored Pre-proline 0 N--CA 1.494 1.762 0 N-CA-C 108.579 -0.897 . . . . 40.0 108.579 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.65 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 85.4 Cg_exo -43.21 140.11 3.72 Favored 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 121.915 1.744 . . . . 40.0 112.239 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.619 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.16 -165.8 11.4 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.819 -1.312 . . . . 40.0 109.819 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.578 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 pttm 171.45 -154.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 107.6 -1.259 . . . . 40.0 107.6 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.4 ' N ' ' HG3' ' A' ' 66' ' ' LYS . 17.6 p -74.57 81.91 2.0 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.245 -1.391 . . . . 40.0 107.245 176.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.578 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.85 105.19 0.21 Allowed Glycine 0 N--CA 1.499 2.872 0 N-CA-C 108.762 -1.735 . . . . 40.0 108.762 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.62 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -126.53 141.52 51.84 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.654 -0.909 . . . . 40.0 110.155 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.795 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 27.8 p -108.71 130.13 55.36 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.955 -0.757 . . . . 40.0 108.955 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.65 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 33.5 m95 -121.78 146.24 47.25 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 119.522 -0.871 . . . . 40.0 110.895 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.8 OUTLIER -147.13 140.77 25.65 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.095 -1.003 . . . . 40.0 109.314 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -111.85 164.59 12.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.0 -1.062 . . . . 40.0 111.17 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -151.41 147.12 26.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.693 -0.63 . . . . 40.0 109.62 178.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.633 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.51 155.8 40.23 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.097 -1.002 . . . . 40.0 110.583 -178.503 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.0 mm -139.19 151.81 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.255 -0.903 . . . . 40.0 110.147 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.541 HD21 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 57.96 53.88 6.49 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.311 0.577 . . . . 40.0 111.096 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.463 ' CG ' ' N ' ' A' ' 79' ' ' THR . 61.5 t80 -118.32 153.78 33.41 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.314 -0.866 . . . . 40.0 108.997 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.563 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.9 p -132.8 -79.09 0.49 Allowed 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.739 0.781 . . . . 40.0 109.765 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.563 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.26 101.83 2.72 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 109.387 -0.597 . . . . 40.0 109.387 -178.918 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -104.99 0.27 Allowed Glycine 0 N--CA 1.5 2.913 0 N-CA-C 109.643 -1.383 . . . . 40.0 109.643 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.478 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 23.1 t80 -125.85 -178.0 4.13 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.522 -0.987 . . . . 40.0 109.882 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 3.0 mtm180 -83.55 -152.02 0.12 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.43 -0.793 . . . . 40.0 110.456 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 38.4 p-10 -164.01 -132.58 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.686 -0.857 . . . . 40.0 108.686 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.4 p -116.48 -9.63 11.4 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.199 -0.938 . . . . 40.0 109.575 -178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.541 ' CG ' HD21 ' A' ' 77' ' ' ASN . 12.6 m-20 -75.01 108.99 8.1 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-N 116.4 -0.364 . . . . 40.0 110.758 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.78 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.57 140.14 44.42 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.232 -0.917 . . . . 40.0 110.395 179.393 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 11.8 tt -108.57 148.98 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-O 122.533 1.159 . . . . 40.0 110.341 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -126.94 124.65 39.99 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.431 -0.951 . . . . 40.0 108.431 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.522 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.3 p90 -128.36 141.38 51.44 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 108.968 -0.753 . . . . 40.0 108.968 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.558 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 59.4 p -107.51 -178.4 3.62 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.083 -1.01 . . . . 40.0 112.017 -176.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.795 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.58 -55.81 22.54 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.403 1.097 . . . . 40.0 108.34 177.464 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.62 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -64.63 5.28 0.31 Allowed 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 114.419 -1.264 . . . . 40.0 110.388 -179.187 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.486 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 66.3 m95 70.46 14.65 7.36 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.74 -0.6 . . . . 40.0 111.856 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.42 127.89 34.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 119.66 -1.9 . . . . 40.0 106.719 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.502 HD11 ' CB ' ' A' ' 11' ' ' ALA . 3.0 mt -115.96 134.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 CA-C-O 122.803 1.287 . . . . 40.0 111.602 -177.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 13.9 m-85 -126.91 157.22 39.98 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.269 -1.382 . . . . 40.0 107.269 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.429 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.3 144.75 50.99 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 118.929 -1.108 . . . . 40.0 112.39 -178.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.17 132.68 38.28 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.772 -1.195 . . . . 40.0 107.772 177.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.2 p -117.87 9.2 12.82 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-O 120.91 0.386 . . . . 40.0 109.973 -177.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.573 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.99 33.18 5.38 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.768 -0.773 . . . . 40.0 109.973 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 63.17 70.13 0.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.975 -1.078 . . . . 40.0 110.362 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 56.49 48.33 16.99 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.52 -0.737 . . . . 40.0 109.835 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.573 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 27.3 mm-40 -120.0 -77.71 0.58 Allowed 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.724 -1.235 . . . . 40.0 109.339 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.518 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 17.7 p -94.78 120.58 35.23 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.724 -1.235 . . . . 40.0 110.155 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.527 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -102.28 86.4 2.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.417 -0.802 . . . . 40.0 110.545 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.4 m -79.13 146.9 32.92 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.199 -0.938 . . . . 40.0 109.036 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.594 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 58.0 tttp -78.04 146.87 35.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.796 -0.565 . . . . 40.0 110.41 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.479 HG13 ' N ' ' A' ' 110' ' ' ARG . 22.4 pt -128.98 -32.0 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 N-CA-C 109.126 -0.694 . . . . 40.0 109.126 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.608 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 108.493 -0.929 . . . . 40.0 108.493 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.68 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.6 t . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.647 -0.501 . . . . 40.0 109.647 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.523 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -137.88 148.93 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.243 -0.911 . . . . 40.0 109.065 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -149.05 34.03 0.74 Allowed 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.209 -0.932 . . . . 40.0 109.798 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 24.4 p -120.09 142.91 48.45 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 119.635 -0.826 . . . . 40.0 110.56 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -43.28 -84.98 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 CA-C-O 121.952 0.882 . . . . 40.0 112.573 -179.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.615 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.6 OUTLIER -45.82 -47.56 15.8 Favored 'General case' 0 C--N 1.283 -2.298 0 O-C-N 121.853 -0.529 . . . . 40.0 110.035 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.62 -49.92 50.96 Favored Glycine 0 N--CA 1.502 3.048 0 N-CA-C 110.331 -1.108 . . . . 40.0 110.331 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -66.17 -43.97 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.224 -1.162 . . . . 40.0 108.562 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.412 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -56.86 -58.33 8.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.252 -0.905 . . . . 40.0 109.388 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.05 -49.38 63.58 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.368 0.604 . . . . 40.0 109.605 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.609 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.6 t80 -53.67 -48.96 68.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.011 0.91 . . . . 40.0 109.65 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.54 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 29.9 mt -69.63 -46.12 66.93 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.805 -0.559 . . . . 40.0 110.658 -178.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -64.72 -22.11 66.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.429 -0.794 . . . . 40.0 110.875 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 m -103.25 -43.89 5.33 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.643 -1.286 . . . . 40.0 111.851 -178.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.583 ' C ' ' H ' ' A' ' 19' ' ' LYS . 86.2 m-85 -107.51 -12.6 15.26 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.168 -0.957 . . . . 40.0 111.005 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.54 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 60.56 -30.9 0.06 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.975 -0.453 . . . . 40.0 111.817 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.609 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -69.69 117.48 11.34 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.936 -1.103 . . . . 40.0 108.583 179.254 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mt -44.92 131.75 5.26 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.476 -0.765 . . . . 40.0 109.151 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.451 ' O ' ' N ' ' A' ' 23' ' ' ASN . 71.3 Cg_exo -34.59 132.72 0.17 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.782 2.321 . . . . 40.0 112.549 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.561 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -63.49 74.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.59 0.709 . . . . 40.0 110.479 -179.313 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.68 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 172.37 18.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.578 -0.701 . . . . 40.0 110.681 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -116.57 160.96 19.9 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.52 -0.738 . . . . 40.0 110.978 -178.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.52 152.58 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.249 -0.907 . . . . 40.0 109.151 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.572 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 72.9 p -71.5 151.01 44.3 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.367 0.603 . . . . 40.0 110.093 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -50.67 -51.75 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.74 -1.207 . . . . 40.0 107.74 177.251 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.9 t -47.13 -62.13 1.56 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.282 -0.886 . . . . 40.0 110.232 178.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.572 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 37.3 mt-10 -48.53 -58.67 4.33 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.288 -0.883 . . . . 40.0 109.162 178.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.26 -49.42 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 121.562 0.696 . . . . 40.0 110.067 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -65.07 -50.09 67.49 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.371 0.605 . . . . 40.0 110.32 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.1 -30.36 70.36 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.434 -0.791 . . . . 40.0 110.16 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.9 mt -68.22 -19.69 64.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 40.0 109.215 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.507 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 131.85 -2.19 5.18 Favored Glycine 0 N--CA 1.5 2.922 0 C-N-CA 119.847 -1.168 . . . . 40.0 111.221 178.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -62.56 113.79 3.17 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.697 -1.472 . . . . 40.0 109.047 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -121.69 144.91 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 40.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.79 85.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.442 -0.786 . . . . 40.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.2 p -79.18 52.17 1.27 Allowed 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.266 -1.013 . . . . 40.0 108.266 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -174.83 -52.26 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 109.261 -0.644 . . . . 40.0 109.261 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.65 22.94 76.88 Favored Glycine 0 N--CA 1.5 2.954 0 N-CA-C 109.38 -1.488 . . . . 40.0 109.38 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.507 HD22 ' C ' ' A' ' 34' ' ' GLY . 4.0 p-10 -59.78 126.51 27.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.58 -0.953 . . . . 40.0 110.304 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.445 ' O ' ' N ' ' A' ' 46' ' ' ALA . 0.9 OUTLIER -165.53 -57.59 0.03 OUTLIER 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.552 -0.907 . . . . 40.0 108.552 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.422 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . . . -53.93 -29.14 41.04 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.264 -0.897 . . . . 40.0 109.865 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -63.0 1.37 Allowed 'General case' 0 N--CA 1.504 2.228 0 CA-C-O 121.553 0.692 . . . . 40.0 109.732 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.6 m -71.1 -23.76 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.409 -0.807 . . . . 40.0 110.403 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.493 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -148.78 76.38 9.75 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.153 -0.967 . . . . 40.0 109.461 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.422 ' HA ' ' HA ' ' A' ' 43' ' ' ALA . 2.8 Cg_exo -61.82 57.28 0.12 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.213 1.942 . . . . 40.0 113.097 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 146.62 36.18 0.06 OUTLIER Glycine 0 N--CA 1.504 3.179 0 N-CA-C 110.71 -0.956 . . . . 40.0 110.71 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.442 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 9.4 tttt -118.48 144.14 46.22 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.724 -1.457 . . . . 40.0 109.995 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.8 m -117.02 134.36 54.85 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.217 -0.927 . . . . 40.0 109.314 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 8.7 mm -65.01 148.41 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 CA-C-O 121.675 0.75 . . . . 40.0 109.719 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.81 145.34 4.12 Favored Glycine 0 N--CA 1.494 2.529 0 C-N-CA 119.002 -1.57 . . . . 40.0 111.151 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.14 17.52 3.0 Favored Glycine 0 N--CA 1.494 2.564 0 C-N-CA 119.986 -1.102 . . . . 40.0 111.11 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.644 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -73.33 -166.58 0.34 Allowed 'General case' 0 C--O 1.196 -1.713 0 O-C-N 120.844 -1.386 . . . . 40.0 109.908 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -134.72 140.48 45.5 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.688 0 CA-C-O 121.555 0.693 . . . . 40.0 109.826 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -152.26 146.35 25.35 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.542 -0.724 . . . . 40.0 109.727 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.679 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.23 -18.37 21.75 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.497 -0.752 . . . . 40.0 110.529 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.482 HD22 ' H ' ' A' ' 63' ' ' LEU . 63.3 t30 69.3 29.04 4.67 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.113 -0.992 . . . . 40.0 111.633 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.679 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.45 -30.83 63.35 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.039 -1.038 . . . . 40.0 108.213 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 24.5 mp0 -64.75 -10.3 26.6 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.369 -0.604 . . . . 40.0 109.369 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.29 44.89 97.03 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.031 -1.228 . . . . 40.0 110.031 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.582 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -94.95 -13.16 25.6 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.603 -0.939 . . . . 40.0 109.249 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.482 ' H ' HD22 ' A' ' 58' ' ' ASN . 24.3 mt -135.18 164.05 46.63 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 108.378 -0.971 . . . . 40.0 108.378 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.565 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 94.8 Cg_exo -44.08 138.13 6.82 Favored 'Trans proline' 0 N--CA 1.495 1.595 0 C-N-CA 121.83 1.687 . . . . 40.0 112.006 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.608 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.15 -167.4 11.94 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 110.205 -1.158 . . . . 40.0 110.205 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.526 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.2 pttm 173.7 -158.67 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.15 -1.426 . . . . 40.0 107.15 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.6 p -73.6 92.29 1.93 Allowed 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.371 -1.344 . . . . 40.0 107.371 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.526 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.1 98.99 0.11 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.116 -1.593 . . . . 40.0 109.116 -178.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.608 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.9 tpp180 -124.49 138.79 54.31 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.7 -0.882 . . . . 40.0 109.587 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.732 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 22.4 p -106.79 130.64 54.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.5 -0.926 . . . . 40.0 108.5 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.565 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 30.6 m95 -122.43 145.49 48.24 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.379 -0.826 . . . . 40.0 110.545 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.531 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.0 OUTLIER -142.95 145.36 32.93 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.289 -0.882 . . . . 40.0 109.583 -179.236 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -114.8 166.44 11.76 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.09 -1.006 . . . . 40.0 111.557 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -156.02 143.6 19.42 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.275 -0.891 . . . . 40.0 110.371 178.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.653 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.3 OUTLIER -66.87 153.38 43.62 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.313 -0.867 . . . . 40.0 111.188 -178.79 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.427 HG13 ' HB ' ' A' ' 88' ' ' ILE . 18.7 mm -136.98 153.5 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.393 -0.817 . . . . 40.0 109.799 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.481 HD21 ' CG ' ' A' ' 86' ' ' ASP . 74.8 m-20 56.44 51.62 11.13 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.064 0.459 . . . . 40.0 111.872 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.475 ' CG ' ' N ' ' A' ' 79' ' ' THR . 59.3 t80 -117.39 154.01 32.06 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.126 -0.983 . . . . 40.0 109.323 178.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.615 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.4 p -131.97 -79.61 0.51 Allowed 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.058 0.932 . . . . 40.0 109.424 178.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.615 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -150.89 106.0 3.33 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.773 -0.825 . . . . 40.0 108.773 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 150.76 -107.79 0.36 Allowed Glycine 0 N--CA 1.499 2.883 0 N-CA-C 109.803 -1.319 . . . . 40.0 109.803 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.444 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.7 t80 -125.08 -177.97 4.03 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.345 -1.091 . . . . 40.0 109.376 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.444 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -82.6 -151.74 0.1 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.418 -0.801 . . . . 40.0 110.37 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.4 HD22 ' HB2' ' A' ' 77' ' ' ASN . 36.8 p30 -163.92 -134.21 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.253 -1.017 . . . . 40.0 108.253 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 53.3 p -116.02 -9.05 11.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.891 -1.131 . . . . 40.0 109.621 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.481 ' CG ' HD21 ' A' ' 77' ' ' ASN . 19.7 m-20 -74.45 109.53 8.01 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 120.798 0.333 . . . . 40.0 110.414 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.769 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.45 139.9 44.45 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 119.521 -0.872 . . . . 40.0 109.951 179.31 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.427 ' HB ' HG13 ' A' ' 76' ' ' ILE . 18.9 tt -108.79 149.1 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-O 122.403 1.096 . . . . 40.0 110.117 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -125.74 127.21 45.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.355 -0.841 . . . . 40.0 109.026 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.531 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.0 p90 -129.93 140.65 50.9 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.492 -0.558 . . . . 40.0 109.492 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.555 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.5 p -105.4 -178.07 3.55 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-O 122.27 1.033 . . . . 40.0 112.73 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.732 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -56.2 -50.54 70.95 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-O 122.205 1.003 . . . . 40.0 108.645 178.039 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.542 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -70.25 4.95 1.91 Allowed 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 114.656 -1.157 . . . . 40.0 110.234 -178.85 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.451 ' HB2' ' O ' ' A' ' 93' ' ' ASP . 69.7 m95 72.21 17.4 4.99 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.848 -0.532 . . . . 40.0 111.474 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.8 mt -72.04 125.83 28.24 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.901 -1.518 . . . . 40.0 106.901 177.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.412 HD11 ' CB ' ' A' ' 11' ' ' ALA . 2.4 mp -112.97 133.54 58.48 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 CA-C-O 122.798 1.285 . . . . 40.0 111.975 -177.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.586 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 13.3 m-85 -126.14 158.52 35.31 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.402 -1.333 . . . . 40.0 107.402 178.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -126.79 143.75 51.16 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.642 -1.223 . . . . 40.0 112.462 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.415 HG22 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.9 129.62 36.63 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.521 -1.289 . . . . 40.0 107.521 177.494 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.7 p -115.6 9.47 15.34 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 109.718 -0.475 . . . . 40.0 109.718 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.567 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.1 35.18 4.45 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 119.799 -0.76 . . . . 40.0 109.36 179.183 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.2 68.76 0.74 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.383 -0.823 . . . . 40.0 111.168 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 62.07 40.37 12.12 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.47 -0.769 . . . . 40.0 110.657 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.567 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.2 mm-40 -114.39 -76.14 0.58 Allowed 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.749 -1.219 . . . . 40.0 110.002 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.522 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 27.5 p -95.13 124.0 38.93 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.706 -1.246 . . . . 40.0 110.068 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.551 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -104.44 84.71 2.23 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.475 -0.765 . . . . 40.0 110.891 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.35 145.42 35.26 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.954 -1.091 . . . . 40.0 108.948 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.639 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 59.1 tttp -76.84 143.72 39.54 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.972 -0.455 . . . . 40.0 110.193 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 36.8 pt -127.45 -31.4 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 109.446 -0.576 . . . . 40.0 109.446 178.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.639 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 1.4 mmt-85 . . . . . 0 N--CA 1.504 2.241 0 N-CA-C 109.157 -0.683 . . . . 40.0 109.157 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.701 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.1 t . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 121.003 0.43 . . . . 40.0 109.983 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.58 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.0 mt -138.02 148.62 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.288 -0.883 . . . . 40.0 109.824 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -149.24 32.62 0.74 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.265 -0.897 . . . . 40.0 109.515 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 37.9 p -118.65 139.23 51.85 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.782 0.801 . . . . 40.0 110.314 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -40.62 -87.95 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 122.291 1.043 . . . . 40.0 113.367 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.642 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.5 OUTLIER -44.13 -48.78 9.13 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 115.734 -0.666 . . . . 40.0 109.877 -179.042 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.48 -50.49 41.54 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 110.298 -1.121 . . . . 40.0 110.298 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.7 t -65.42 -46.32 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.019 -1.283 . . . . 40.0 109.099 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -55.17 -57.89 9.9 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.573 0.701 . . . . 40.0 110.119 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.21 -49.72 63.34 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.681 -0.637 . . . . 40.0 109.672 178.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.638 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 18.5 t80 -51.65 -50.17 60.87 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.312 1.053 . . . . 40.0 108.605 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.58 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 25.6 mt -69.28 -45.12 70.41 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.592 -0.731 . . . . 40.0 111.006 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -65.08 -21.61 66.84 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 40.0 110.926 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.9 m -103.09 -44.7 5.14 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.015 -1.053 . . . . 40.0 111.56 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.595 ' C ' ' H ' ' A' ' 19' ' ' LYS . 88.9 m-85 -105.53 -13.63 15.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.129 -0.982 . . . . 40.0 111.42 -177.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.58 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 59.77 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 121.303 0.573 . . . . 40.0 111.759 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.638 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.65 117.92 14.93 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 120.494 -1.379 . . . . 40.0 108.886 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -45.84 128.44 6.89 Favored Pre-proline 0 C--N 1.296 -1.74 0 O-C-N 121.328 -0.858 . . . . 40.0 109.461 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' CE2' ' A' ' 13' ' ' TYR . 75.1 Cg_exo -34.11 133.31 0.14 Allowed 'Trans proline' 0 N--CA 1.489 1.251 0 C-N-CA 122.976 2.451 . . . . 40.0 112.988 -179.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.575 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -64.78 75.75 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.806 0.812 . . . . 40.0 110.791 -178.827 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.701 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 171.83 16.05 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.862 -0.523 . . . . 40.0 110.919 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -113.06 167.42 10.54 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.432 -0.793 . . . . 40.0 111.353 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -158.16 150.89 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.067 -1.021 . . . . 40.0 108.801 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.511 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 82.3 p -69.7 154.23 42.27 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.384 0.611 . . . . 40.0 109.548 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.659 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -53.29 -50.72 64.3 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.148 -1.427 . . . . 40.0 107.148 176.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -47.65 -62.13 1.6 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.51 -0.744 . . . . 40.0 110.544 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.511 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 40.1 mt-10 -49.05 -57.61 6.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.347 -0.845 . . . . 40.0 109.172 178.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.9 -49.99 61.92 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.581 -0.699 . . . . 40.0 109.71 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.406 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 51.4 mt-30 -64.05 -50.07 69.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.689 -0.632 . . . . 40.0 110.762 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.89 -32.79 74.28 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.429 -0.794 . . . . 40.0 109.953 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mt -64.89 -20.68 66.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.268 -0.895 . . . . 40.0 109.334 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.517 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 131.49 -2.02 5.31 Favored Glycine 0 N--CA 1.498 2.767 0 N-CA-C 110.668 -0.973 . . . . 40.0 110.668 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -59.97 114.01 2.6 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.73 -1.453 . . . . 40.0 109.299 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.27 143.44 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 CA-C-O 121.926 0.869 . . . . 40.0 111.168 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.3 78.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.797 -0.564 . . . . 40.0 110.392 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.5 p -79.32 52.08 1.3 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.016 -1.053 . . . . 40.0 108.452 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -175.49 -52.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.095 -0.706 . . . . 40.0 109.095 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.22 18.14 76.43 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.517 HD22 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -52.96 130.35 33.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.943 -0.739 . . . . 40.0 109.905 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 46' ' ' ALA . 3.7 tp -169.34 -57.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.517 -0.92 . . . . 40.0 108.517 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.68 -25.36 53.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.231 -0.918 . . . . 40.0 109.934 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -77.87 -60.05 2.53 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.122 -0.695 . . . . 40.0 109.122 -179.794 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.2 m -74.27 -22.46 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.527 -0.733 . . . . 40.0 109.64 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.548 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . -148.77 78.78 8.88 Favored Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 40.0 109.339 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -56.24 50.55 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 123.311 2.674 . . . . 40.0 113.998 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.547 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.17 0.06 OUTLIER Glycine 0 N--CA 1.504 3.175 0 C-N-CA 119.911 -1.138 . . . . 40.0 111.047 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.469 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 18.6 tttt -120.14 145.59 46.79 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 120.906 -1.349 . . . . 40.0 109.662 179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.8 m -116.61 136.3 53.09 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.306 -0.871 . . . . 40.0 109.642 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.5 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.9 mm -69.63 153.79 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.866 . . . . 40.0 110.223 -179.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.77 143.98 3.83 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 119.048 -1.548 . . . . 40.0 110.401 179.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 128.88 13.2 2.5 Favored Glycine 0 N--CA 1.496 2.636 0 C-N-CA 119.495 -1.336 . . . . 40.0 111.217 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.659 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -73.99 -172.83 1.43 Allowed 'General case' 0 C--O 1.195 -1.804 0 O-C-N 120.904 -1.35 . . . . 40.0 110.84 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.48 143.74 40.06 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 CA-C-O 121.701 0.762 . . . . 40.0 110.173 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -155.94 147.2 22.53 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.31 -0.868 . . . . 40.0 109.54 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.65 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.19 -16.6 24.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.739 -0.601 . . . . 40.0 110.636 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.9 t30 66.19 28.09 10.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.17 -0.956 . . . . 40.0 111.72 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.655 ' HB2' ' CZ ' ' A' ' 59' ' ' ARG . 1.1 mtm-85 -56.45 -31.06 63.62 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.023 -1.048 . . . . 40.0 108.384 178.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.488 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 17.4 mp0 -61.93 -12.1 16.46 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.903 -0.777 . . . . 40.0 108.903 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.55 40.44 99.13 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 110.003 -1.239 . . . . 40.0 110.003 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.554 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -93.99 -10.51 33.37 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.828 -0.807 . . . . 40.0 109.23 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.521 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 36.9 mt -135.62 162.64 55.92 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 108.032 -1.099 . . . . 40.0 108.032 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.663 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 97.3 Cg_exo -44.79 139.52 7.54 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 121.536 1.491 . . . . 40.0 112.298 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.497 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.94 -169.58 12.49 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 110.361 -1.096 . . . . 40.0 110.361 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.471 ' HB3' ' NH2' ' A' ' 69' ' ' ARG . 3.4 pttm 175.35 -156.66 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.924 -1.51 . . . . 40.0 106.924 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -74.41 84.54 1.97 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.546 -1.279 . . . . 40.0 107.546 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.442 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.42 102.82 0.2 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 108.417 -1.873 . . . . 40.0 108.417 -178.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.564 HH11 ' CG ' ' A' ' 93' ' ' ASP . 15.6 tpp180 -125.51 141.55 51.98 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.869 -0.783 . . . . 40.0 109.55 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.741 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 25.5 p -108.88 131.31 55.13 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.741 -0.837 . . . . 40.0 108.741 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.663 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.2 m95 -121.91 147.97 45.34 Favored 'General case' 0 N--CA 1.5 2.047 0 C-N-CA 119.453 -0.899 . . . . 40.0 111.014 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.565 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.3 mpp_? -146.02 144.72 30.26 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.183 -0.948 . . . . 40.0 109.676 -178.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.643 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.09 165.55 13.01 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.146 -0.971 . . . . 40.0 111.515 179.558 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -152.16 147.5 26.5 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.504 -0.748 . . . . 40.0 109.574 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.679 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -71.38 150.77 44.71 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.592 -0.693 . . . . 40.0 110.244 -179.061 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.462 HG13 ' HB ' ' A' ' 88' ' ' ILE . 15.5 mm -134.66 150.59 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 40.0 109.916 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.509 HD21 ' CG ' ' A' ' 86' ' ' ASP . 76.7 m-20 58.26 60.15 2.76 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-O 121.235 0.541 . . . . 40.0 111.485 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.475 ' CG ' ' N ' ' A' ' 79' ' ' THR . 66.2 t80 -123.87 154.28 39.89 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.103 -0.998 . . . . 40.0 109.385 178.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.588 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.0 p -132.19 -80.38 0.5 Allowed 'General case' 0 N--CA 1.502 2.154 0 CA-C-O 121.719 0.771 . . . . 40.0 110.005 179.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.588 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.16 102.01 2.75 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 109.167 -0.679 . . . . 40.0 109.167 -179.107 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.88 -104.32 0.26 Allowed Glycine 0 N--CA 1.5 2.965 0 N-CA-C 109.833 -1.307 . . . . 40.0 109.833 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.451 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.8 t80 -125.79 -178.42 4.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.47 -1.018 . . . . 40.0 109.934 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.456 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.7 mtm180 -83.86 -151.88 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.655 -0.653 . . . . 40.0 110.425 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.466 HD22 ' HB2' ' A' ' 86' ' ' ASP . 47.7 p-10 -164.7 -136.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.851 -0.796 . . . . 40.0 108.851 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.4 p -113.13 -11.85 13.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.993 -1.067 . . . . 40.0 109.871 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.509 ' CG ' HD21 ' A' ' 77' ' ' ASN . 11.8 m-20 -71.79 109.17 5.49 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 120.964 0.412 . . . . 40.0 110.518 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.789 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.85 140.55 44.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.533 -0.729 . . . . 40.0 110.025 179.657 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.488 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.9 tt -111.23 149.93 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 CA-C-O 122.375 1.084 . . . . 40.0 109.757 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -127.18 127.54 44.67 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 109.326 -0.62 . . . . 40.0 109.326 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.565 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.6 p90 -131.65 141.76 49.69 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 109.116 -0.698 . . . . 40.0 109.116 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.511 ' HB3' ' CE2' ' A' ' 71' ' ' TRP . 64.3 p -107.61 -179.86 4.03 Favored 'General case' 0 N--CA 1.505 2.287 0 CA-C-O 122.22 1.01 . . . . 40.0 112.418 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.741 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.77 -50.54 63.34 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 122.35 1.072 . . . . 40.0 108.636 178.508 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.564 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 3.83 1.84 Allowed 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.598 -1.183 . . . . 40.0 110.241 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.463 ' HB2' ' O ' ' A' ' 93' ' ' ASP . 78.5 m95 72.53 13.59 5.36 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.764 -0.585 . . . . 40.0 111.758 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 21.1 mt -70.01 128.9 37.94 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.819 -1.8 . . . . 40.0 107.562 178.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.429 ' HA ' ' O ' ' A' ' 89' ' ' LEU . 2.5 mt -114.59 135.54 54.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 CA-C-O 122.707 1.241 . . . . 40.0 112.527 -176.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.569 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.8 m-85 -127.75 156.49 42.35 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.377 -1.342 . . . . 40.0 107.377 179.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 4.7 ptmm? -125.31 143.64 50.87 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 118.758 -1.177 . . . . 40.0 112.73 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.84 132.09 38.19 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.233 -1.395 . . . . 40.0 107.233 177.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 4.0 p -117.9 11.56 13.51 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 109.566 -0.531 . . . . 40.0 109.566 -177.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.579 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -116.32 32.97 5.8 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.902 -0.719 . . . . 40.0 109.798 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 64.37 66.62 0.61 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.012 -1.055 . . . . 40.0 111.03 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 60.76 43.2 12.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.266 -0.896 . . . . 40.0 110.472 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.579 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.6 mm-40 -116.37 -76.81 0.57 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.621 -1.299 . . . . 40.0 109.104 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.515 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.9 p -94.25 122.27 36.61 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.67 -1.269 . . . . 40.0 109.785 -178.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.554 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 4.9 m-85 -104.11 84.73 2.27 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.54 -0.725 . . . . 40.0 110.972 -179.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 m -77.9 144.51 36.84 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.916 -1.115 . . . . 40.0 109.314 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.692 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 60.5 tttp -75.83 147.72 38.93 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.41 -0.806 . . . . 40.0 110.592 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.435 ' O ' ' HG2' ' A' ' 110' ' ' ARG . 38.8 pt -129.81 -31.14 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 109.223 -0.658 . . . . 40.0 109.223 178.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.692 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.15 0 CA-C-O 118.514 -0.755 . . . . 40.0 109.097 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.663 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 109.917 -0.401 . . . . 40.0 109.917 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.573 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.7 mt -140.13 147.79 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 40.0 109.068 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -149.98 35.03 0.67 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.072 -1.017 . . . . 40.0 109.454 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.6 p -119.76 144.07 47.47 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 119.577 -0.849 . . . . 40.0 110.512 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -45.23 -85.56 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 N-CA-C 113.471 0.915 . . . . 40.0 113.471 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.628 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.14 -46.26 17.08 Favored 'General case' 0 C--N 1.288 -2.071 0 O-C-N 121.623 -0.673 . . . . 40.0 110.117 -179.294 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.03 60.45 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.732 -0.947 . . . . 40.0 110.732 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.6 t -66.84 -42.11 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.019 -1.283 . . . . 40.0 108.29 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.418 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -60.51 -55.4 33.88 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.961 -1.087 . . . . 40.0 109.585 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.23 -50.24 62.37 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.478 -0.764 . . . . 40.0 109.186 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.607 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 19.2 t80 -52.78 -49.54 65.37 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.72 0.772 . . . . 40.0 109.81 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.647 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.6 mt -68.6 -45.8 71.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.596 -0.69 . . . . 40.0 109.855 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -64.05 -23.02 67.17 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.6 -1.24 . . . . 40.0 110.625 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.2 m -105.41 -41.76 5.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.66 -1.275 . . . . 40.0 111.66 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.596 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.2 m-85 -103.46 -16.08 15.69 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.762 -1.211 . . . . 40.0 110.846 -177.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.647 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.45 -36.64 0.11 Allowed 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 121.546 0.688 . . . . 40.0 110.662 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.607 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -66.86 118.72 10.75 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 120.83 -1.168 . . . . 40.0 108.265 179.06 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.439 ' HA ' HD23 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -45.51 132.93 6.19 Favored Pre-proline 0 N--CA 1.499 2.02 0 O-C-N 121.366 -0.834 . . . . 40.0 108.923 -179.222 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.479 ' O ' ' N ' ' A' ' 23' ' ' ASN . 62.6 Cg_exo -35.31 134.14 0.2 Allowed 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 122.246 1.964 . . . . 40.0 112.557 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.75 73.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.695 0.759 . . . . 40.0 110.067 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.663 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.0 p-10 174.05 19.23 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.763 -0.585 . . . . 40.0 111.197 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -118.04 162.04 18.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.489 0.662 . . . . 40.0 111.542 -178.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -150.64 152.43 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.275 -0.891 . . . . 40.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.593 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 76.2 p -72.4 151.7 42.46 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.532 -0.73 . . . . 40.0 109.407 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.646 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -48.7 -53.66 17.94 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.121 -1.066 . . . . 40.0 108.121 177.517 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.5 t -46.19 -63.42 0.99 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.547 -0.721 . . . . 40.0 110.312 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.593 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 36.1 mt-10 -48.27 -58.4 4.61 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.202 -0.937 . . . . 40.0 108.962 179.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.72 -49.41 62.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.353 -0.842 . . . . 40.0 110.228 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.443 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 55.6 mt-30 -64.99 -48.97 72.07 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.44 -0.787 . . . . 40.0 110.255 -178.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.28 -31.85 72.9 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.576 -0.703 . . . . 40.0 110.985 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mt -67.68 -19.3 65.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.498 -0.751 . . . . 40.0 109.075 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.483 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 131.14 0.4 5.1 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 119.945 -1.121 . . . . 40.0 111.358 178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -62.61 114.08 3.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.595 -1.532 . . . . 40.0 108.603 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.3 t -122.11 140.92 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.548 0 CA-C-O 121.891 0.853 . . . . 40.0 110.377 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.51 -47.02 85.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.44 -0.787 . . . . 40.0 109.886 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.6 p -77.74 50.42 0.84 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.886 -1.134 . . . . 40.0 109.063 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -175.79 -48.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.137 0.494 . . . . 40.0 109.767 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.5 72.76 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 108.912 -1.675 . . . . 40.0 108.912 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.483 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.3 p-10 -56.04 130.76 45.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.798 -0.825 . . . . 40.0 109.326 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.0 tp -170.1 -58.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.66 -0.867 . . . . 40.0 108.66 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.54 -25.48 52.09 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.388 -0.82 . . . . 40.0 109.673 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.435 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -75.63 -65.22 0.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.0 -0.741 . . . . 40.0 109.0 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.2 m -67.14 -29.83 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.428 -0.795 . . . . 40.0 109.753 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -140.46 77.71 23.19 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.746 -0.596 . . . . 40.0 110.227 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.83 50.02 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 123.276 2.65 . . . . 40.0 113.829 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.18 43.83 0.04 OUTLIER Glycine 0 N--CA 1.497 2.733 0 C-N-CA 119.556 -1.307 . . . . 40.0 111.375 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -121.75 145.04 48.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.874 -1.368 . . . . 40.0 109.436 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 m -119.26 133.74 55.59 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.797 -1.189 . . . . 40.0 110.455 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.457 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.8 mm -65.49 153.48 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.19 -0.944 . . . . 40.0 110.216 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.467 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.37 145.63 4.17 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.525 -1.43 . . . . 40.0 109.525 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 125.42 15.4 3.03 Favored Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.877 -1.154 . . . . 40.0 111.181 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.513 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -74.81 -166.86 0.5 Allowed 'General case' 0 C--O 1.194 -1.863 0 O-C-N 120.576 -1.544 . . . . 40.0 110.332 -179.077 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.5 mm -134.54 139.57 47.52 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.706 0 CA-C-O 121.6 0.714 . . . . 40.0 109.581 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -151.62 146.99 26.22 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.894 -0.78 . . . . 40.0 108.894 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.683 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -94.16 -18.06 22.12 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 40.0 109.672 -179.186 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.482 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.6 t30 68.71 30.24 4.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.359 -0.838 . . . . 40.0 111.917 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.683 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 0.9 OUTLIER -57.92 -29.98 65.55 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.904 -1.122 . . . . 40.0 108.134 178.534 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.9 mp0 -64.35 -11.38 31.83 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.324 0.583 . . . . 40.0 109.462 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.2 44.5 98.04 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 110.339 -1.104 . . . . 40.0 110.339 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.584 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -95.48 -12.74 25.36 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.566 -0.961 . . . . 40.0 108.828 179.849 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.482 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 52.3 mt -136.8 162.17 57.49 Favored Pre-proline 0 N--CA 1.497 1.912 0 N-CA-C 108.318 -0.993 . . . . 40.0 108.318 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.493 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 86.6 Cg_exo -43.75 142.36 3.47 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 122.103 1.869 . . . . 40.0 112.667 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.624 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.77 -165.94 11.35 Favored Glycine 0 N--CA 1.492 2.429 0 C-N-CA 120.018 -1.087 . . . . 40.0 110.915 -178.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.635 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.3 pttm 173.5 -157.79 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 107.775 -1.194 . . . . 40.0 107.775 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.6 p -73.54 86.23 1.57 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 106.983 -1.488 . . . . 40.0 106.983 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.635 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.91 99.59 0.23 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.295 -1.522 . . . . 40.0 109.295 -178.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.626 HH11 ' CG ' ' A' ' 93' ' ' ASP . 18.5 tpp180 -121.85 140.84 51.89 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.388 -1.066 . . . . 40.0 110.031 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.732 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 24.8 p -109.4 130.83 55.48 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 108.123 -1.066 . . . . 40.0 108.123 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.493 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 33.8 m95 -121.82 143.69 49.26 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.324 -0.86 . . . . 40.0 111.16 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.556 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.1 mpp_? -141.61 147.5 37.73 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.453 -0.779 . . . . 40.0 109.692 -178.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.646 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -119.24 169.82 9.64 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 119.551 -0.86 . . . . 40.0 112.058 179.897 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.467 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -157.34 145.27 19.05 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.521 -0.737 . . . . 40.0 110.272 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.636 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -69.36 151.93 45.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.667 -0.645 . . . . 40.0 110.292 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.424 HG13 ' HB ' ' A' ' 88' ' ' ILE . 14.5 mm -135.95 152.65 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.178 -0.951 . . . . 40.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.5 HD21 ' CG ' ' A' ' 86' ' ' ASP . 75.1 m-20 57.94 51.15 9.3 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.01 0.433 . . . . 40.0 111.507 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.474 ' CG ' ' N ' ' A' ' 79' ' ' THR . 57.1 t80 -116.85 153.13 33.05 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.972 -1.08 . . . . 40.0 109.217 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.604 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.7 p -132.8 -77.55 0.49 Allowed 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.854 0.835 . . . . 40.0 109.608 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.604 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.58 102.28 2.71 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 109.442 -0.577 . . . . 40.0 109.442 -179.392 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 153.09 -104.27 0.25 Allowed Glycine 0 N--CA 1.499 2.874 0 N-CA-C 109.841 -1.304 . . . . 40.0 109.841 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 11.8 t80 -126.03 -179.41 4.69 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.681 -0.894 . . . . 40.0 109.91 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.46 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.3 mtm180 -80.96 -150.87 0.08 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 121.581 0.705 . . . . 40.0 110.049 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.413 HD22 ' HB2' ' A' ' 77' ' ' ASN . 27.3 p30 -164.3 -136.62 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.182 -1.044 . . . . 40.0 108.182 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 50.6 p -114.04 -9.12 13.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.808 -1.183 . . . . 40.0 109.192 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.5 ' CG ' HD21 ' A' ' 77' ' ' ASN . 18.3 m-20 -73.69 109.36 7.14 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.287 -0.415 . . . . 40.0 110.394 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.787 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.12 137.25 40.81 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.369 -0.832 . . . . 40.0 110.258 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.424 ' HB ' HG13 ' A' ' 76' ' ' ILE . 15.2 tt -108.39 145.88 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 122.61 1.195 . . . . 40.0 110.592 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -123.1 127.23 48.44 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.841 -0.8 . . . . 40.0 108.841 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.0 p90 -132.05 140.72 48.98 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.746 -0.835 . . . . 40.0 108.746 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.487 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.6 p -107.23 178.46 4.54 Favored 'General case' 0 N--CA 1.51 2.56 0 CA-C-O 122.511 1.148 . . . . 40.0 112.662 -176.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.732 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -49.77 -54.97 15.84 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.569 1.176 . . . . 40.0 108.353 177.164 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.626 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -67.75 6.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.51 -1.223 . . . . 40.0 111.098 -178.848 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.427 ' H ' ' C ' ' A' ' 92' ' ' SER . 67.4 m95 70.76 15.22 6.97 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.807 -0.558 . . . . 40.0 112.172 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.9 mt -70.37 127.14 31.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.169 -1.582 . . . . 40.0 106.819 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.418 HD11 ' CB ' ' A' ' 11' ' ' ALA . 2.3 mp -113.92 135.21 54.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-O 123.004 1.383 . . . . 40.0 112.224 -177.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.633 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.0 m-85 -128.43 158.17 39.06 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.577 -1.268 . . . . 40.0 107.577 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.437 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.9 ptmm? -126.69 145.97 50.38 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.714 -1.195 . . . . 40.0 112.566 -178.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.93 130.58 33.94 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.282 -1.377 . . . . 40.0 107.282 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 2.4 p -116.13 11.07 15.14 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.234 -0.654 . . . . 40.0 109.234 -177.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.562 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -117.29 34.71 4.99 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.723 -0.791 . . . . 40.0 109.498 178.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.8 68.33 0.7 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.431 -0.793 . . . . 40.0 111.02 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 60.1 43.85 13.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.429 -0.795 . . . . 40.0 110.279 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.562 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 28.7 mm-40 -116.47 -77.89 0.57 Allowed 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.833 -1.167 . . . . 40.0 108.66 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.483 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.4 p -94.25 120.21 34.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.737 -1.227 . . . . 40.0 110.642 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.584 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 10.0 m-85 -101.01 82.73 2.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.342 -0.848 . . . . 40.0 111.589 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.2 m -75.54 142.1 42.86 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.038 -1.038 . . . . 40.0 109.372 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.643 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 61.4 tttp -76.45 148.87 36.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.539 -0.726 . . . . 40.0 110.452 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.43 ' O ' ' HG2' ' A' ' 110' ' ' ARG . 32.7 pt -131.4 -30.13 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 109.144 -0.687 . . . . 40.0 109.144 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.643 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.903 0 CA-C-O 118.394 -0.812 . . . . 40.0 109.088 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.68 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.5 t . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.176 -0.676 . . . . 40.0 109.176 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.554 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.05 150.34 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.468 -0.77 . . . . 40.0 108.992 -179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -150.06 35.15 0.66 Allowed 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.159 -0.963 . . . . 40.0 109.397 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.4 p -119.27 141.58 48.83 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.924 -0.71 . . . . 40.0 110.331 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -43.54 -84.39 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.024 0.916 . . . . 40.0 112.904 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.591 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.97 -47.09 21.92 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 121.724 -0.61 . . . . 40.0 110.08 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.05 -48.53 62.66 Favored Glycine 0 N--CA 1.502 3.046 0 N-CA-C 110.497 -1.041 . . . . 40.0 110.497 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -44.11 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.4 . . . . 40.0 108.452 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.417 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -57.81 -58.04 10.11 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.607 -0.683 . . . . 40.0 110.12 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -51.11 61.35 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.693 -0.855 . . . . 40.0 108.693 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.616 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.9 t80 -50.35 -50.21 51.78 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.931 0.872 . . . . 40.0 109.671 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.561 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 24.4 mt -69.69 -45.17 68.9 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.543 -0.723 . . . . 40.0 110.481 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -63.53 -20.89 66.0 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 119.411 -0.915 . . . . 40.0 111.417 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.1 m -105.73 -45.02 4.51 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.692 -1.255 . . . . 40.0 111.463 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.602 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.6 m-85 -102.9 -15.07 16.29 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.351 -0.843 . . . . 40.0 110.913 -177.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.561 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-70 60.6 -30.5 0.06 Allowed 'General case' 0 N--CA 1.505 2.322 0 CA-C-O 121.447 0.641 . . . . 40.0 111.045 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.616 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -69.72 117.99 12.02 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.695 -1.253 . . . . 40.0 108.792 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.424 HD21 ' HD2' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -46.5 132.17 7.98 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.47 -0.769 . . . . 40.0 109.427 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.424 ' HD2' HD21 ' A' ' 20' ' ' LEU . 67.7 Cg_exo -36.59 133.66 0.35 Allowed 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.866 2.377 . . . . 40.0 112.5 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.566 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -64.67 75.62 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.011 0.91 . . . . 40.0 110.433 -179.174 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.68 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 174.0 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.733 -0.605 . . . . 40.0 110.406 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.449 ' HA ' ' O ' ' A' ' 50' ' ' SER . 18.1 m-85 -114.52 163.96 14.65 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.426 -0.796 . . . . 40.0 111.396 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.98 152.06 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.45 -0.781 . . . . 40.0 109.417 178.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.593 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 61.2 p -72.39 150.75 43.13 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 108.909 -0.774 . . . . 40.0 108.909 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.641 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -49.98 -52.19 35.67 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.529 -0.915 . . . . 40.0 108.529 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -46.74 -61.58 1.78 Allowed 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.446 -0.784 . . . . 40.0 110.268 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.593 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 41.8 mt-10 -50.76 -56.64 11.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.153 -0.967 . . . . 40.0 109.234 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.97 -49.02 66.96 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.459 -0.776 . . . . 40.0 109.739 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.4 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 50.2 mt-30 -65.65 -49.22 69.43 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.751 -0.593 . . . . 40.0 110.291 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.68 -31.04 70.74 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.399 -0.813 . . . . 40.0 110.351 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.38 -18.85 65.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.134 -0.979 . . . . 40.0 109.267 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.55 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 133.04 -4.2 4.95 Favored Glycine 0 N--CA 1.497 2.719 0 C-N-CA 119.871 -1.157 . . . . 40.0 111.087 178.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -62.02 116.04 4.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.544 -1.562 . . . . 40.0 108.746 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 31.0 t -124.12 142.6 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 121.87 0.843 . . . . 40.0 110.506 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.06 83.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.353 -0.842 . . . . 40.0 110.561 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 p -77.68 48.17 0.66 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.825 -1.172 . . . . 40.0 109.318 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -173.58 -50.3 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.572 -0.705 . . . . 40.0 109.328 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.18 24.59 76.5 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 108.974 -1.651 . . . . 40.0 108.974 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.55 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.8 p-10 -58.77 130.83 48.8 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.748 -0.854 . . . . 40.0 109.42 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.523 ' O ' ' N ' ' A' ' 46' ' ' ALA . 5.2 tp -170.77 -56.69 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.295 -1.002 . . . . 40.0 108.295 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.09 -23.27 32.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 40.0 109.906 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.485 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -78.79 -66.28 0.88 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.899 -0.778 . . . . 40.0 108.899 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.436 ' H ' ' CG ' ' A' ' 44' ' ' ASP . 24.5 m -67.32 -26.98 37.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 109.079 -0.712 . . . . 40.0 109.079 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.562 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -142.5 77.97 16.77 Favored Pre-proline 0 N--CA 1.488 1.443 0 O-C-N 121.411 -0.806 . . . . 40.0 109.982 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.95 50.01 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.972 2.448 . . . . 40.0 113.966 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.44 42.22 0.05 OUTLIER Glycine 0 N--CA 1.5 2.942 0 C-N-CA 119.766 -1.207 . . . . 40.0 111.338 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.445 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 13.4 tttt -119.83 147.69 44.36 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.906 -1.349 . . . . 40.0 110.035 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.449 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 13.1 m -117.6 134.1 55.24 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.155 -0.965 . . . . 40.0 109.994 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.3 mm -67.47 154.89 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.921 -1.112 . . . . 40.0 110.589 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 149.63 150.62 5.29 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.491 -1.338 . . . . 40.0 110.049 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 122.34 17.04 3.7 Favored Glycine 0 N--CA 1.494 2.561 0 O-C-N 121.213 -1.169 . . . . 40.0 110.739 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.641 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -75.64 -167.65 0.72 Allowed 'General case' 0 C--O 1.198 -1.628 0 O-C-N 120.989 -1.301 . . . . 40.0 110.426 -179.345 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.462 HG21 HD12 ' A' ' 55' ' ' ILE . 3.8 mm -134.46 141.56 43.13 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.542 0 CA-C-O 121.506 0.669 . . . . 40.0 110.239 -179.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -153.46 145.91 24.06 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.173 -0.954 . . . . 40.0 110.033 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.655 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -92.24 -17.54 24.67 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.444 -0.785 . . . . 40.0 110.14 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.451 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 66.5 t30 67.21 32.9 5.79 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.06 -1.025 . . . . 40.0 111.419 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.664 ' HB2' ' CZ ' ' A' ' 59' ' ' ARG . 0.8 OUTLIER -60.84 -29.32 69.43 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.981 -1.074 . . . . 40.0 108.439 178.529 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.437 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 23.8 mp0 -64.63 -13.91 55.72 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.526 -0.546 . . . . 40.0 109.526 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.25 42.69 94.05 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 109.683 -1.367 . . . . 40.0 109.683 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.556 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -95.57 -10.27 30.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.647 -0.914 . . . . 40.0 109.197 -179.592 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.451 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 30.7 mt -138.94 164.05 42.12 Favored Pre-proline 0 N--CA 1.492 1.659 0 N-CA-C 108.535 -0.913 . . . . 40.0 108.535 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.624 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 87.0 Cg_exo -45.16 139.91 8.16 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.025 1.817 . . . . 40.0 111.659 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.643 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.04 -166.29 11.69 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 110.392 -1.083 . . . . 40.0 110.392 -178.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.611 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 pttm 173.33 -158.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 107.859 -1.163 . . . . 40.0 107.859 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.2 p -73.64 85.42 1.6 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.165 -1.42 . . . . 40.0 107.165 177.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.611 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 79.72 99.94 0.28 Allowed Glycine 0 N--CA 1.496 2.679 0 N-CA-C 108.863 -1.695 . . . . 40.0 108.863 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.643 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 16.9 tpp180 -123.45 140.89 52.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.535 -0.979 . . . . 40.0 110.508 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.746 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 29.5 p -108.83 130.25 55.4 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.632 -0.877 . . . . 40.0 108.632 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.624 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 30.7 m95 -121.48 146.85 46.49 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.343 -0.848 . . . . 40.0 110.381 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.62 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.9 OUTLIER -145.89 146.88 31.26 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.538 -0.726 . . . . 40.0 109.624 -179.21 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.613 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.3 170.72 8.32 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.177 -1.009 . . . . 40.0 112.352 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.449 ' O ' HG22 ' A' ' 88' ' ' ILE . . . -157.36 145.41 19.13 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.487 -0.758 . . . . 40.0 109.981 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.663 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -70.44 153.25 43.16 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.551 -0.718 . . . . 40.0 110.408 -179.206 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.44 HG13 ' HB ' ' A' ' 88' ' ' ILE . 17.8 mm -137.61 153.37 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 40.0 110.088 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.473 HD21 ' CG ' ' A' ' 86' ' ' ASP . 73.8 m-20 55.07 58.49 4.69 Favored 'General case' 0 N--CA 1.5 2.033 0 CA-C-O 121.186 0.517 . . . . 40.0 111.267 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.488 ' CG ' ' N ' ' A' ' 79' ' ' THR . 56.1 t80 -121.83 155.2 35.87 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 40.0 108.739 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.556 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.8 p -132.32 -79.91 0.5 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 121.672 0.749 . . . . 40.0 109.84 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.556 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.27 101.67 2.86 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.88 -0.785 . . . . 40.0 108.88 -179.284 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.14 -109.09 0.4 Allowed Glycine 0 N--CA 1.5 2.952 0 C-N-CA 119.753 -1.213 . . . . 40.0 110.108 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.445 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.5 t80 -119.42 -177.97 3.49 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.358 -1.084 . . . . 40.0 110.06 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.445 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 4.2 mtm180 -84.47 -150.33 0.12 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.463 -0.773 . . . . 40.0 110.561 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 38.7 p30 -164.98 -135.93 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.743 -0.836 . . . . 40.0 108.743 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 45.6 p -114.21 -10.25 12.77 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.835 -1.166 . . . . 40.0 109.417 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.473 ' CG ' HD21 ' A' ' 77' ' ' ASN . 15.5 m-20 -73.04 106.43 4.91 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.95 0.405 . . . . 40.0 110.131 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.812 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -134.05 139.27 45.88 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 119.585 -0.846 . . . . 40.0 110.172 179.768 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 74' ' ' ALA . 18.1 tt -110.12 148.78 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-O 122.064 0.935 . . . . 40.0 110.56 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.427 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.0 mm? -125.21 128.5 48.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.582 -0.699 . . . . 40.0 109.393 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.62 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.4 p90 -131.07 141.71 50.21 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 109.043 -0.725 . . . . 40.0 109.043 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.536 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 60.0 p -107.28 -179.11 3.83 Favored 'General case' 0 N--CA 1.504 2.252 0 CA-C-O 122.162 0.982 . . . . 40.0 112.209 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.746 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -54.55 -53.6 52.33 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.324 1.059 . . . . 40.0 108.794 177.735 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.583 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -65.9 2.2 1.14 Allowed 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 114.643 -1.162 . . . . 40.0 109.975 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.487 ' HB2' ' O ' ' A' ' 93' ' ' ASP . 78.5 m95 73.56 16.85 3.88 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 122.017 -0.427 . . . . 40.0 111.652 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 24.4 mt -70.52 126.56 29.97 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 106.79 -1.559 . . . . 40.0 106.79 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.417 HD11 ' CB ' ' A' ' 11' ' ' ALA . 2.7 mp -114.26 134.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 122.706 1.241 . . . . 40.0 112.013 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.53 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 10.3 m-85 -127.68 158.88 36.4 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.95 -1.13 . . . . 40.0 107.95 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.413 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.4 ptmm? -127.13 145.79 50.62 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 118.634 -1.226 . . . . 40.0 112.291 -178.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.426 HG22 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.97 129.81 32.69 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 106.897 -1.52 . . . . 40.0 106.897 177.433 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.4 p -115.98 9.93 15.0 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 109.585 -0.524 . . . . 40.0 109.585 -177.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.573 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.2 34.21 5.0 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.821 -0.751 . . . . 40.0 109.818 178.947 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 62.46 67.47 0.72 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.16 -0.963 . . . . 40.0 111.077 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 61.15 43.21 11.34 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -0.825 . . . . 40.0 110.451 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.573 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.5 mm-40 -115.88 -77.92 0.57 Allowed 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.614 -1.304 . . . . 40.0 109.267 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.484 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.2 p -93.74 120.82 34.51 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.068 -1.02 . . . . 40.0 110.207 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.556 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 6.1 m-85 -102.73 83.77 2.31 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.378 0.609 . . . . 40.0 110.685 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.28 144.88 35.75 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.213 -0.995 . . . . 40.0 108.903 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.669 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 57.8 tttp -76.67 146.99 37.75 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.214 0.53 . . . . 40.0 110.322 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.424 ' O ' ' HG2' ' A' ' 110' ' ' ARG . 15.6 pt -130.22 -28.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 109.148 -0.686 . . . . 40.0 109.148 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.669 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 N-CA-C 109.128 -0.693 . . . . 40.0 109.128 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.676 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.8 t . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 109.249 -0.649 . . . . 40.0 109.249 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.589 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 10.6 mt -139.24 147.7 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.453 -0.78 . . . . 40.0 109.415 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -149.55 34.4 0.7 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.276 -0.89 . . . . 40.0 109.712 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.3 p -119.51 144.75 46.85 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.913 -0.715 . . . . 40.0 110.115 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -45.6 -86.83 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.49 -0.757 . . . . 40.0 112.752 -178.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.625 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -46.18 -48.05 17.61 Favored 'General case' 0 C--N 1.289 -2.061 0 O-C-N 121.672 -0.643 . . . . 40.0 109.761 -178.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.14 -53.35 23.62 Favored Glycine 0 N--CA 1.502 3.071 0 N-CA-C 110.149 -1.18 . . . . 40.0 110.149 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.83 -44.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 O-C-N 120.867 -1.372 . . . . 40.0 109.733 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.76 -57.06 14.09 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.257 -0.902 . . . . 40.0 109.934 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.99 -47.05 65.07 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 178.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.452 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.7 t80 -54.63 -50.26 68.54 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.901 0.858 . . . . 40.0 109.057 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.686 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 72.2 mt -70.72 -44.7 66.31 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.727 -0.608 . . . . 40.0 110.618 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.401 ' HG3' HD13 ' A' ' 96' ' ' ILE . 4.9 mt-30 -61.73 -26.86 68.32 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 119.122 -1.031 . . . . 40.0 110.722 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.9 m -102.28 -44.22 5.47 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.872 -1.143 . . . . 40.0 111.926 -178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.612 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.5 m-85 -102.85 -16.2 15.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.906 -1.121 . . . . 40.0 110.425 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.686 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 62.1 -27.58 0.06 Allowed 'General case' 0 N--CA 1.502 2.169 0 CA-C-O 121.36 0.6 . . . . 40.0 110.895 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.612 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -71.28 122.41 20.21 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 120.82 -1.175 . . . . 40.0 108.756 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.0 mt -47.29 132.36 9.76 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.428 -0.795 . . . . 40.0 109.144 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -40.0 131.71 2.07 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 122.199 1.932 . . . . 40.0 112.626 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.625 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.47 78.59 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.876 0.845 . . . . 40.0 110.335 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.676 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 170.47 15.17 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.915 -0.491 . . . . 40.0 110.503 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.426 ' HA ' ' O ' ' A' ' 50' ' ' SER . 17.5 m-85 -114.18 167.13 10.95 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.497 -0.752 . . . . 40.0 111.233 -179.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.55 152.1 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 40.0 109.049 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.595 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 77.8 p -72.17 151.67 42.8 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 108.405 -0.961 . . . . 40.0 108.405 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.646 ' HZ3' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -50.83 -51.9 46.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.759 -1.213 . . . . 40.0 108.38 177.883 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.7 t -46.32 -62.91 1.14 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.841 -0.537 . . . . 40.0 110.252 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.595 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 45.2 mt-10 -48.74 -58.02 5.42 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.019 -0.734 . . . . 40.0 109.019 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.18 -49.33 64.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.591 -0.693 . . . . 40.0 109.575 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -64.86 -48.21 75.11 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.369 -0.832 . . . . 40.0 111.034 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -31.8 72.1 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 40.0 110.746 -179.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.92 -20.51 65.92 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.77 -0.826 . . . . 40.0 108.77 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.532 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 132.61 -3.66 5.05 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 120.127 -1.035 . . . . 40.0 111.031 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -60.94 114.32 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.549 -1.56 . . . . 40.0 108.318 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.8 142.85 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.376 -0.828 . . . . 40.0 110.48 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.46 -48.97 79.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.495 -0.753 . . . . 40.0 110.648 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 p -78.09 46.88 0.62 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.112 -0.992 . . . . 40.0 109.147 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -169.92 -50.37 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 108.824 -0.806 . . . . 40.0 108.824 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.92 20.23 75.96 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.1 -1.6 . . . . 40.0 109.1 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.532 HD22 ' C ' ' A' ' 34' ' ' GLY . 6.7 p-10 -55.19 127.23 28.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.68 -0.894 . . . . 40.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 46' ' ' ALA . 5.4 tp -166.83 -55.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 108.533 -0.914 . . . . 40.0 108.533 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -29.74 53.41 Favored 'General case' 0 C--N 1.288 -2.069 0 O-C-N 121.052 -1.03 . . . . 40.0 110.065 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -62.73 1.34 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.396 -0.815 . . . . 40.0 109.443 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.403 ' H ' HG22 ' A' ' 45' ' ' VAL . 24.4 m -71.57 -23.18 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-N 116.23 -0.441 . . . . 40.0 109.988 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.551 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -148.11 76.2 10.44 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 120.981 -1.075 . . . . 40.0 108.937 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -58.73 53.27 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.504 0 C-N-CA 122.391 2.06 . . . . 40.0 113.274 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.69 38.05 0.06 OUTLIER Glycine 0 N--CA 1.5 2.951 0 C-N-CA 119.913 -1.137 . . . . 40.0 111.577 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 19.9 tttt -119.72 148.34 43.51 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.795 -1.415 . . . . 40.0 110.092 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.426 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 5.2 m -120.26 134.8 55.19 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.136 -0.978 . . . . 40.0 109.93 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.452 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.9 mm -67.05 155.35 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -0.966 . . . . 40.0 110.815 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.477 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.43 148.08 4.67 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 119.615 -1.279 . . . . 40.0 110.257 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 123.53 15.99 3.53 Favored Glycine 0 N--CA 1.496 2.642 0 C-N-CA 119.865 -1.159 . . . . 40.0 110.997 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.646 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -74.31 -168.87 0.71 Allowed 'General case' 0 C--O 1.192 -1.936 0 O-C-N 121.04 -1.27 . . . . 40.0 110.386 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -132.85 140.92 46.26 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 CA-C-O 121.728 0.775 . . . . 40.0 110.423 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -153.43 148.12 26.31 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.475 -0.765 . . . . 40.0 109.149 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.682 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.29 -19.96 20.22 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.465 -0.772 . . . . 40.0 110.211 -179.165 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.8 t30 69.95 31.19 3.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.448 -0.782 . . . . 40.0 111.889 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.682 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.4 mtm-85 -59.02 -31.15 68.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.821 -1.174 . . . . 40.0 108.129 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.466 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 22.0 mp0 -62.88 -8.92 7.95 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.228 -0.656 . . . . 40.0 109.228 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 58.55 44.05 95.7 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.367 -1.093 . . . . 40.0 110.367 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.598 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -95.61 -12.29 25.86 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.61 -0.935 . . . . 40.0 108.78 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.479 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 28.3 mt -136.2 162.69 55.06 Favored Pre-proline 0 N--CA 1.499 2.024 0 N-CA-C 108.135 -1.061 . . . . 40.0 108.135 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.464 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 93.5 Cg_exo -42.78 142.32 2.14 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 121.98 1.786 . . . . 40.0 112.622 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.609 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.62 -166.42 11.5 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.002 -1.239 . . . . 40.0 110.002 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.557 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.0 pttm 171.5 -158.48 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 107.126 -1.435 . . . . 40.0 107.126 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.0 p -72.4 87.71 1.17 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 107.012 -1.477 . . . . 40.0 107.012 177.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.557 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.42 103.97 0.11 Allowed Glycine 0 N--CA 1.498 2.772 0 N-CA-C 109.559 -1.416 . . . . 40.0 109.559 -178.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.62 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -124.02 140.85 52.57 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.529 -0.983 . . . . 40.0 110.347 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.777 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 24.1 p -105.99 130.04 54.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.279 -1.008 . . . . 40.0 108.279 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.544 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 31.3 m95 -124.27 140.38 53.02 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.726 -0.789 . . . . 40.0 110.585 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.533 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.7 OUTLIER -143.5 149.55 37.67 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.286 -0.883 . . . . 40.0 108.926 -179.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.636 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -116.76 175.34 5.62 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.293 -0.879 . . . . 40.0 112.65 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.477 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -162.24 142.53 10.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.557 -0.715 . . . . 40.0 110.27 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.65 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -67.73 153.17 44.31 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.74 -0.6 . . . . 40.0 110.844 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.438 HG13 ' HB ' ' A' ' 88' ' ' ILE . 13.8 mm -136.93 151.61 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.382 -0.823 . . . . 40.0 109.798 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.473 HD21 ' CG ' ' A' ' 86' ' ' ASP . 76.9 m-20 57.27 53.71 7.43 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.143 0.496 . . . . 40.0 111.98 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.469 ' CG ' ' N ' ' A' ' 79' ' ' THR . 60.3 t80 -118.1 155.14 30.91 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.159 -0.963 . . . . 40.0 109.123 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.565 ' OG1' ' N ' ' A' ' 80' ' ' SER . 42.0 p -133.28 -78.2 0.48 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.716 0.769 . . . . 40.0 109.876 178.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.565 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.74 102.94 2.89 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 109.078 -0.712 . . . . 40.0 109.078 -179.546 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -105.95 0.29 Allowed Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.788 -1.325 . . . . 40.0 109.788 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.431 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 14.1 t80 -126.38 -175.83 3.49 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -1.031 . . . . 40.0 109.942 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.432 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.5 mtm180 -84.75 -153.44 0.16 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.417 -0.802 . . . . 40.0 110.38 -178.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -163.7 -135.13 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.759 -0.83 . . . . 40.0 108.759 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 28.1 p -113.84 -10.55 12.96 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.975 -1.078 . . . . 40.0 109.791 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.473 ' CG ' HD21 ' A' ' 77' ' ' ASN . 14.1 m-20 -73.91 108.21 6.59 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 120.858 0.361 . . . . 40.0 110.821 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.787 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.03 140.48 45.64 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.469 -0.892 . . . . 40.0 110.391 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.438 ' HB ' HG13 ' A' ' 76' ' ' ILE . 18.1 tt -111.33 148.33 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 CA-C-O 122.108 0.956 . . . . 40.0 109.917 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -124.82 128.74 49.18 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.478 -0.764 . . . . 40.0 109.082 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.459 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.25 141.58 50.02 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.273 -0.892 . . . . 40.0 109.67 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.544 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.7 p -106.52 179.57 4.23 Favored 'General case' 0 N--CA 1.505 2.314 0 CA-C-O 122.51 1.148 . . . . 40.0 112.666 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.777 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.82 -51.98 58.8 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.381 1.086 . . . . 40.0 109.118 177.863 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.62 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 5.1 1.24 Allowed 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 114.673 -1.149 . . . . 40.0 110.2 -178.955 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.509 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 61.6 m95 72.76 11.52 5.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.882 -0.511 . . . . 40.0 112.097 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 23.1 mt -67.73 125.14 25.29 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 119.947 -1.72 . . . . 40.0 107.835 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.415 HG21 HD12 ' A' ' 109' ' ' ILE . 2.2 mt -112.62 133.25 59.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 122.865 1.317 . . . . 40.0 112.724 -176.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.568 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 16.0 m-85 -125.21 157.68 35.89 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 107.77 -1.196 . . . . 40.0 107.77 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.417 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.92 141.24 51.6 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 119.205 -0.998 . . . . 40.0 112.934 -177.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.83 131.33 40.9 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.484 -1.302 . . . . 40.0 107.484 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.9 p -116.44 10.35 14.6 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 109.397 -0.594 . . . . 40.0 109.397 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.549 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -115.3 33.16 5.6 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.585 -0.846 . . . . 40.0 109.854 179.293 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 63.98 66.68 0.64 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.262 -0.899 . . . . 40.0 111.071 178.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 60.88 43.25 12.03 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.386 -0.821 . . . . 40.0 110.108 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.549 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.4 mm-40 -116.26 -76.92 0.57 Allowed 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.712 -1.243 . . . . 40.0 109.217 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.529 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.9 p -94.81 121.96 36.94 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.664 -1.273 . . . . 40.0 110.433 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.598 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -102.9 86.14 2.67 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 40.0 110.584 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.5 m -79.28 146.42 32.99 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.197 -1.001 . . . . 40.0 108.334 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.644 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 57.5 tttp -78.28 146.32 34.89 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.304 0.573 . . . . 40.0 110.371 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.441 ' O ' ' HG2' ' A' ' 110' ' ' ARG . 29.1 pt -126.97 -31.66 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 N-CA-C 108.933 -0.766 . . . . 40.0 108.933 177.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.644 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.586 -0.721 . . . . 40.0 109.269 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.651 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.7 t . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 109.488 -0.56 . . . . 40.0 109.488 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.528 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.3 mt -137.97 149.74 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.461 -0.774 . . . . 40.0 109.419 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -149.22 36.07 0.74 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.046 -1.034 . . . . 40.0 109.745 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p -119.9 140.51 50.75 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.451 -0.9 . . . . 40.0 110.518 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -41.2 -80.66 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.179 0.514 . . . . 40.0 111.746 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.54 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -50.65 -45.83 58.07 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.566 -0.709 . . . . 40.0 111.108 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.04 -52.0 37.69 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 109.977 -1.249 . . . . 40.0 109.977 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.47 -44.27 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.404 -1.056 . . . . 40.0 109.672 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.462 ' CB ' HD11 ' A' ' 96' ' ' ILE . . . -58.66 -55.04 40.17 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.681 0.753 . . . . 40.0 109.408 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -44.36 88.66 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.953 -0.758 . . . . 40.0 108.953 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.513 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.9 t80 -56.91 -48.24 78.7 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 122.233 1.016 . . . . 40.0 108.52 178.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.438 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 39.8 mt -68.73 -45.7 70.82 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.774 -0.579 . . . . 40.0 110.3 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -65.17 -24.34 67.35 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 118.66 -1.216 . . . . 40.0 111.22 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.3 m -98.27 -43.79 6.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.845 -1.159 . . . . 40.0 111.571 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.599 ' C ' ' H ' ' A' ' 19' ' ' LYS . 74.5 m-85 -108.98 -11.98 14.92 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.188 -0.945 . . . . 40.0 111.223 -177.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.497 ' CG ' ' CZ2' ' A' ' 94' ' ' TRP . 2.3 m-70 61.27 -25.62 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 121.567 0.699 . . . . 40.0 111.041 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.599 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -72.9 121.55 20.19 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 120.313 -1.492 . . . . 40.0 108.988 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.02 129.34 12.07 Favored Pre-proline 0 C--N 1.283 -2.309 0 O-C-N 121.463 -0.773 . . . . 40.0 109.281 179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.426 ' O ' ' N ' ' A' ' 23' ' ' ASN . 73.9 Cg_exo -33.62 133.48 0.12 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.624 2.216 . . . . 40.0 113.052 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.588 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -64.0 74.98 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.653 0.739 . . . . 40.0 110.258 -179.354 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.651 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 171.72 18.21 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.719 -0.613 . . . . 40.0 110.322 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -115.28 165.15 13.27 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.601 -0.687 . . . . 40.0 110.735 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -155.93 149.87 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 108.744 -0.835 . . . . 40.0 108.744 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.559 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 69.8 p -69.47 153.68 43.16 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.422 -0.799 . . . . 40.0 110.02 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.29 -51.46 58.44 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.14 -1.43 . . . . 40.0 107.14 177.042 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.8 t -47.36 -62.23 1.53 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.48 -0.763 . . . . 40.0 110.362 178.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.559 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 38.9 mt-10 -49.28 -57.2 7.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.356 -0.84 . . . . 40.0 109.356 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.04 -49.43 66.33 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.674 0.749 . . . . 40.0 109.79 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -63.58 -49.59 72.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.728 -0.607 . . . . 40.0 110.16 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.51 -30.02 68.75 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 40.0 110.519 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 mt -66.72 -19.73 65.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.107 -0.996 . . . . 40.0 109.077 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.489 ' C ' HD22 ' A' ' 41' ' ' ASN . . . 131.74 -1.4 5.14 Favored Glycine 0 N--CA 1.499 2.835 0 C-N-CA 120.073 -1.061 . . . . 40.0 111.143 179.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -61.54 114.88 3.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.657 -1.496 . . . . 40.0 109.301 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.8 t -123.32 140.24 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 O-C-N 121.262 -0.899 . . . . 40.0 109.962 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.39 -49.36 78.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 40.0 110.171 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 p -76.64 47.55 0.5 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.218 -0.926 . . . . 40.0 109.425 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -170.89 -49.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.645 -0.659 . . . . 40.0 109.283 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.62 17.4 74.78 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 109.173 -1.571 . . . . 40.0 109.173 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.489 HD22 ' C ' ' A' ' 34' ' ' GLY . 7.4 p-10 -55.61 130.95 45.09 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.455 -1.026 . . . . 40.0 108.946 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 46' ' ' ALA . 1.4 tp -169.85 -55.77 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.704 -1.221 . . . . 40.0 107.704 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.76 -27.38 63.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.324 -0.86 . . . . 40.0 110.241 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.02 -57.31 3.95 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.847 0.832 . . . . 40.0 109.455 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.2 m -72.54 -29.4 30.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.955 -1.128 . . . . 40.0 107.955 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.552 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . -143.05 79.38 14.48 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 121.557 -0.714 . . . . 40.0 110.306 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.11 54.9 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 122.081 1.854 . . . . 40.0 113.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.12 40.7 0.06 OUTLIER Glycine 0 N--CA 1.503 3.135 0 C-N-CA 119.758 -1.211 . . . . 40.0 111.408 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -121.54 138.99 54.07 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.947 -1.325 . . . . 40.0 109.872 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 m -111.99 132.43 54.79 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.032 -1.043 . . . . 40.0 109.283 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.483 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.3 mm -63.54 151.29 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.373 -0.829 . . . . 40.0 110.028 -179.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.98 144.49 3.92 Favored Glycine 0 N--CA 1.488 2.116 0 C-N-CA 118.789 -1.672 . . . . 40.0 110.651 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 126.79 15.33 2.64 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 119.841 -1.171 . . . . 40.0 111.225 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.654 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -72.79 -170.36 0.69 Allowed 'General case' 0 C--O 1.198 -1.63 0 O-C-N 120.841 -1.388 . . . . 40.0 110.205 -179.291 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 5.6 mm -134.11 138.96 49.27 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-O 121.489 0.662 . . . . 40.0 110.203 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -151.03 148.83 28.83 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.581 -0.699 . . . . 40.0 109.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.612 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.68 -21.16 19.53 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.504 -0.748 . . . . 40.0 110.777 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 66.3 t30 71.12 28.12 3.15 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 40.0 111.839 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.612 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.7 mtm-85 -56.64 -32.36 65.27 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.957 -1.089 . . . . 40.0 108.151 178.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.433 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 24.6 mp0 -63.46 -9.22 11.73 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.401 -0.592 . . . . 40.0 109.401 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.93 44.66 97.86 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.236 -1.146 . . . . 40.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.634 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -93.8 -12.85 28.16 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.649 -0.912 . . . . 40.0 108.552 179.679 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.488 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 36.5 mt -138.04 166.57 25.01 Favored Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 108.744 -0.836 . . . . 40.0 108.744 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.619 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 81.7 Cg_exo -46.36 136.57 15.11 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 121.862 1.708 . . . . 40.0 112.387 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.622 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -125.81 -168.56 12.7 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.436 -1.466 . . . . 40.0 109.436 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.592 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 4.0 pttm 175.35 -156.28 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 106.867 -1.531 . . . . 40.0 106.867 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.2 p -75.85 87.15 2.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.32 -1.487 . . . . 40.0 107.155 177.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.592 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 76.89 105.83 0.15 Allowed Glycine 0 N--CA 1.497 2.756 0 N-CA-C 108.262 -1.935 . . . . 40.0 108.262 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.622 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.1 tpp180 -128.08 142.72 51.13 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.388 -1.066 . . . . 40.0 110.419 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.729 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.75 130.07 55.37 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 108.89 -0.782 . . . . 40.0 108.89 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.619 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 31.3 m95 -123.33 143.57 50.01 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 119.931 -0.708 . . . . 40.0 110.838 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.511 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.6 OUTLIER -145.28 148.47 33.5 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.243 -0.91 . . . . 40.0 109.693 -179.363 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -115.39 169.74 8.93 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.227 -0.92 . . . . 40.0 111.856 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -156.01 144.37 20.01 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.336 -0.616 . . . . 40.0 109.336 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.638 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -69.59 154.32 42.17 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.621 -0.674 . . . . 40.0 110.631 -178.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.402 HG13 ' HB ' ' A' ' 88' ' ' ILE . 16.9 mm -137.08 152.67 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.164 -0.96 . . . . 40.0 109.908 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.484 HD21 ' CG ' ' A' ' 86' ' ' ASP . 74.3 m-20 56.35 57.18 5.11 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.031 0.444 . . . . 40.0 111.492 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.466 ' CG ' ' N ' ' A' ' 79' ' ' THR . 65.1 t80 -120.85 153.66 36.83 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.257 -0.902 . . . . 40.0 109.317 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.551 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.2 p -132.55 -78.63 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.888 0.851 . . . . 40.0 109.602 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.551 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.44 102.17 2.72 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.855 -0.794 . . . . 40.0 108.855 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.48 -104.92 0.26 Allowed Glycine 0 N--CA 1.498 2.819 0 C-N-CA 119.557 -1.306 . . . . 40.0 109.961 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.1 t80 -126.59 -176.15 3.6 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.638 -0.919 . . . . 40.0 109.453 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.419 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.6 mtm180 -84.19 -150.69 0.12 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.379 -0.826 . . . . 40.0 110.212 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.404 HD22 ' HB2' ' A' ' 86' ' ' ASP . 41.9 p-10 -164.77 -134.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.567 -0.901 . . . . 40.0 108.567 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 26.5 p -115.66 -9.78 11.92 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.048 -1.033 . . . . 40.0 109.681 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.484 ' CG ' HD21 ' A' ' 77' ' ' ASN . 20.3 m-20 -75.17 108.76 8.13 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 120.798 0.332 . . . . 40.0 110.821 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.788 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.22 140.15 45.06 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.34 -0.944 . . . . 40.0 109.734 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.402 ' HB ' HG13 ' A' ' 76' ' ' ILE . 13.8 tt -109.75 148.48 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 CA-C-O 122.019 0.914 . . . . 40.0 110.137 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -124.18 129.15 50.32 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.768 -0.827 . . . . 40.0 108.768 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.501 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 5.6 p90 -132.53 140.94 48.53 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 109.658 -0.497 . . . . 40.0 109.658 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.519 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 71.5 p -107.54 -178.86 3.75 Favored 'General case' 0 N--CA 1.506 2.366 0 CA-C-O 122.292 1.044 . . . . 40.0 112.504 -177.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.729 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -55.5 -50.17 70.65 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 122.193 0.997 . . . . 40.0 109.216 177.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.567 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -68.07 1.07 2.99 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.022 -0.99 . . . . 40.0 109.536 -179.375 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.497 ' CZ2' ' CG ' ' A' ' 18' ' ' HIS . 77.2 m95 73.01 17.2 4.2 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 122.089 -0.382 . . . . 40.0 111.116 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 23.4 mt -70.39 125.45 26.85 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.146 -1.428 . . . . 40.0 107.146 177.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.462 HD11 ' CB ' ' A' ' 11' ' ' ALA . 2.6 mp -113.11 133.88 57.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 CA-C-O 122.767 1.27 . . . . 40.0 112.357 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.582 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.1 m-85 -126.75 158.83 35.48 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 107.985 -1.117 . . . . 40.0 107.985 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 4.8 ptmm? -127.71 142.18 51.4 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.218 -0.993 . . . . 40.0 112.983 -177.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.26 130.84 41.43 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.567 -1.272 . . . . 40.0 107.567 176.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.1 p -115.88 8.51 14.76 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 109.534 -0.543 . . . . 40.0 109.534 -178.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.558 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.74 31.62 6.4 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.845 -0.742 . . . . 40.0 110.016 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 65.22 67.27 0.52 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.104 -0.998 . . . . 40.0 111.04 178.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 61.04 43.0 11.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.409 -0.807 . . . . 40.0 110.398 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.558 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 26.6 mm-40 -116.65 -77.39 0.57 Allowed 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.57 -1.331 . . . . 40.0 109.603 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.496 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 20.4 p -94.61 122.41 37.18 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.98 -1.075 . . . . 40.0 110.096 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.572 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.1 m-85 -103.91 84.87 2.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.558 -0.713 . . . . 40.0 110.385 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.5 m -78.24 143.74 36.83 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.918 -1.114 . . . . 40.0 108.519 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.622 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 58.2 tttp -75.03 143.39 43.55 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.666 -0.646 . . . . 40.0 110.621 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.426 HD12 ' CG2' ' A' ' 96' ' ' ILE . 31.9 pt -124.29 -29.96 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.798 -0.815 . . . . 40.0 108.798 177.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.622 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.042 0 CA-C-O 118.719 -0.658 . . . . 40.0 109.304 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.683 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.2 t . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 109.145 -0.687 . . . . 40.0 109.145 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.553 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -139.06 147.61 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.336 -0.853 . . . . 40.0 109.433 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -147.22 33.35 0.89 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.335 -0.853 . . . . 40.0 110.349 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.6 p -117.79 142.17 47.59 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.571 0.701 . . . . 40.0 110.699 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -42.52 -85.64 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 CA-C-O 122.229 1.014 . . . . 40.0 113.392 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.641 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -45.84 -48.27 15.83 Favored 'General case' 0 C--N 1.285 -2.21 0 O-C-N 121.527 -0.733 . . . . 40.0 109.896 -179.952 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.6 -53.82 23.66 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 110.353 -1.099 . . . . 40.0 110.353 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.9 t -63.99 -44.24 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.349 -1.089 . . . . 40.0 109.725 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.97 -54.2 49.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.915 -1.116 . . . . 40.0 109.961 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -45.43 74.68 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.447 0.641 . . . . 40.0 109.505 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.625 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.7 t80 -56.74 -49.77 74.23 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.063 -1.088 . . . . 40.0 108.063 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.703 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.4 mt -68.29 -44.42 75.53 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.897 -0.721 . . . . 40.0 109.592 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.453 ' HG3' HD13 ' A' ' 96' ' ' ILE . 8.1 mt-30 -65.37 -24.1 67.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.715 -1.241 . . . . 40.0 111.154 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 m -99.9 -50.2 4.09 Favored 'General case' 0 N--CA 1.516 2.842 0 O-C-N 121.106 -0.997 . . . . 40.0 111.809 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.65 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.7 m-85 -98.95 -16.23 18.83 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 120.92 -1.112 . . . . 40.0 111.76 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.703 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.12 -19.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 121.395 0.617 . . . . 40.0 111.206 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.65 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -74.1 118.39 17.0 Favored 'General case' 0 C--N 1.291 -1.961 0 O-C-N 121.295 -0.878 . . . . 40.0 109.822 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.459 ' C ' ' O ' ' A' ' 19' ' ' LYS . 4.8 mt -43.84 128.14 4.17 Favored Pre-proline 0 N--CA 1.498 1.936 0 N-CA-C 107.505 -1.294 . . . . 40.0 107.505 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -36.46 134.0 0.33 Allowed 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.008 2.472 . . . . 40.0 112.575 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.627 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -63.76 78.21 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.6 -0.688 . . . . 40.0 110.254 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.683 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 168.24 16.27 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.468 -0.77 . . . . 40.0 110.399 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.417 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.8 m-85 -115.13 166.05 12.25 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 122.021 0.915 . . . . 40.0 110.944 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -155.7 151.25 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.186 -0.947 . . . . 40.0 109.022 178.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.506 ' HG1' ' CD ' ' A' ' 29' ' ' GLU . 80.5 p -70.58 154.43 41.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.34 -0.85 . . . . 40.0 110.241 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.613 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.59 -51.72 58.56 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.228 -1.397 . . . . 40.0 107.228 177.138 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.7 t -46.58 -62.94 1.15 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.615 -0.678 . . . . 40.0 110.064 178.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.506 ' CD ' ' HG1' ' A' ' 26' ' ' THR . 35.4 mt-10 -47.62 -58.15 4.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.408 -0.807 . . . . 40.0 109.435 178.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.71 -50.3 63.63 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.493 -0.755 . . . . 40.0 109.526 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.16 -49.86 72.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.849 -0.532 . . . . 40.0 110.768 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.48 -29.62 68.29 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.23 -0.919 . . . . 40.0 110.467 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -17.02 64.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.767 -1.208 . . . . 40.0 109.079 178.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.518 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 128.12 1.18 6.31 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 120.376 -0.916 . . . . 40.0 111.434 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -64.25 115.56 5.15 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.469 -1.606 . . . . 40.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 51.8 t -122.97 143.29 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 121.355 -0.841 . . . . 40.0 110.401 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.84 -49.09 76.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.572 -0.705 . . . . 40.0 109.97 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 p -78.69 50.62 1.0 Allowed 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.698 -0.853 . . . . 40.0 108.698 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 tttp -172.83 -51.44 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.738 -0.838 . . . . 40.0 108.738 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.99 20.33 76.15 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 108.939 -1.665 . . . . 40.0 108.939 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.518 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 6.2 p-10 -55.73 128.08 33.1 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.987 -0.746 . . . . 40.0 108.987 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.478 ' O ' ' N ' ' A' ' 46' ' ' ALA . 5.1 tp -166.86 -56.65 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.917 0.865 . . . . 40.0 109.074 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.39 -28.57 59.65 Favored 'General case' 0 C--N 1.289 -2.039 0 O-C-N 121.14 -0.975 . . . . 40.0 110.384 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.5 -62.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.532 -0.73 . . . . 40.0 109.299 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.7 m -69.41 -29.66 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 CA-C-O 121.543 0.687 . . . . 40.0 109.977 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.524 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -142.93 78.55 15.35 Favored Pre-proline 0 C--N 1.299 -1.589 0 O-C-N 121.193 -0.942 . . . . 40.0 109.116 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -56.14 51.33 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 122.349 2.033 . . . . 40.0 114.685 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.25 0.06 OUTLIER Glycine 0 N--CA 1.502 3.087 0 C-N-CA 119.463 -1.351 . . . . 40.0 111.112 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 23.8 tttt -122.92 146.19 47.81 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.757 -1.437 . . . . 40.0 109.329 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.417 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 7.6 m -117.3 131.77 56.74 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.708 -1.245 . . . . 40.0 110.848 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 8.0 mm -60.27 149.14 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-O 121.63 0.728 . . . . 40.0 110.866 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.94 147.1 4.49 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.152 -1.499 . . . . 40.0 110.916 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 123.32 17.95 3.17 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.682 -0.77 . . . . 40.0 111.603 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.592 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -74.21 -169.56 0.81 Allowed 'General case' 0 C--O 1.195 -1.774 0 O-C-N 120.801 -1.411 . . . . 40.0 110.074 -179.331 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.19 139.13 50.01 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.801 0 CA-C-O 121.761 0.791 . . . . 40.0 110.2 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -150.3 147.79 28.06 Favored 'General case' 0 C--N 1.293 -1.882 0 C-N-CA 119.926 -0.71 . . . . 40.0 109.96 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.702 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -95.06 -16.66 22.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.818 -0.551 . . . . 40.0 110.03 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.51 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 67.1 t30 68.11 28.46 6.6 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 40.0 111.785 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.702 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.3 mtm-85 -56.78 -31.82 65.03 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.919 -1.113 . . . . 40.0 108.475 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.45 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 21.1 mp0 -61.85 -13.02 20.43 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.344 -0.613 . . . . 40.0 109.344 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.63 43.89 98.33 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.839 -1.304 . . . . 40.0 109.839 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.593 ' NZ ' ' CD1' ' A' ' 106' ' ' PHE . 0.0 OUTLIER -94.47 -12.36 27.86 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.476 -0.935 . . . . 40.0 108.476 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.51 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 31.9 mt -136.26 163.75 47.81 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 109.014 -0.736 . . . . 40.0 109.014 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.582 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 92.1 Cg_exo -43.26 137.61 5.06 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.987 1.791 . . . . 40.0 112.366 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.539 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.19 -169.5 12.51 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.065 -1.214 . . . . 40.0 110.065 -178.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.542 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.9 ptmm? 173.9 -158.81 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.138 -1.43 . . . . 40.0 107.138 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.4 p -73.33 88.51 1.55 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.034 -1.469 . . . . 40.0 107.034 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.542 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 74.79 103.98 0.09 OUTLIER Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.016 -1.634 . . . . 40.0 109.016 -177.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.608 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.0 tpp180 -125.41 143.06 51.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.942 -0.74 . . . . 40.0 109.467 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.763 ' HG1' ' CB ' ' A' ' 92' ' ' SER . 35.2 p -109.78 133.24 53.37 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.832 -1.173 . . . . 40.0 107.832 178.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.591 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 32.7 m95 -127.17 141.37 51.76 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.815 0.817 . . . . 40.0 110.474 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.56 HH12 ' HA ' ' A' ' 92' ' ' SER . 1.0 OUTLIER -144.89 146.67 32.13 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.54 -0.725 . . . . 40.0 109.378 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.613 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -113.93 172.97 6.66 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.154 -0.966 . . . . 40.0 112.354 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -159.22 143.7 15.42 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.766 -0.584 . . . . 40.0 109.734 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.614 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.69 156.37 35.45 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.471 -0.768 . . . . 40.0 110.617 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.433 HG13 ' HB ' ' A' ' 88' ' ' ILE . 13.8 mm -139.69 152.13 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 40.0 109.463 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.485 HD21 ' CG ' ' A' ' 86' ' ' ASP . 70.7 m-20 56.29 54.93 7.15 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.117 -0.492 . . . . 40.0 111.616 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.478 ' CG ' ' N ' ' A' ' 79' ' ' THR . 52.7 t80 -116.72 155.49 28.78 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.997 -1.065 . . . . 40.0 108.968 177.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.557 ' OG1' ' N ' ' A' ' 80' ' ' SER . 32.9 p -132.84 -78.08 0.49 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.82 0.819 . . . . 40.0 109.904 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.557 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.0 OUTLIER -152.47 102.73 2.76 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.155 -1.054 . . . . 40.0 108.155 -179.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 151.87 -108.16 0.36 Allowed Glycine 0 N--CA 1.501 3.022 0 N-CA-C 109.762 -1.335 . . . . 40.0 109.762 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.487 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 20.1 t80 -124.67 -178.06 4.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.304 -1.115 . . . . 40.0 109.357 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.487 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 1.3 mtm180 -83.44 -151.49 0.11 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.795 0.807 . . . . 40.0 110.806 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 40.5 p30 -164.6 -133.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.782 -0.822 . . . . 40.0 108.782 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.5 p -116.08 -9.88 11.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.033 -1.042 . . . . 40.0 110.249 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.485 ' CG ' HD21 ' A' ' 77' ' ' ASN . 17.9 m-20 -74.65 110.9 9.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 122.172 -0.33 . . . . 40.0 110.595 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.782 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -137.15 140.14 41.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.237 -0.914 . . . . 40.0 109.83 179.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.433 ' HB ' HG13 ' A' ' 76' ' ' ILE . 11.1 tt -110.35 148.79 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 122.389 1.09 . . . . 40.0 110.205 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' A' ' 96' ' ' ILE . 2.2 mm? -125.62 128.01 47.2 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.663 -0.648 . . . . 40.0 109.323 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.503 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.46 142.61 50.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.479 -0.763 . . . . 40.0 109.249 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.591 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 90.0 p -107.34 178.51 4.52 Favored 'General case' 0 N--CA 1.504 2.241 0 CA-C-O 122.128 0.966 . . . . 40.0 112.679 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.763 ' CB ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.42 -51.86 56.91 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-O 122.176 0.988 . . . . 40.0 109.059 177.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.608 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.03 5.24 1.22 Allowed 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 114.87 -1.059 . . . . 40.0 109.742 -179.002 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.479 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 77.1 m95 69.53 19.69 7.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 122.05 -0.406 . . . . 40.0 111.608 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 21.7 mt -72.87 127.61 33.05 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.285 -1.746 . . . . 40.0 106.285 177.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.453 HD13 ' HG3' ' A' ' 15' ' ' GLN . 2.4 mp -112.97 135.99 50.67 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.103 0 CA-C-O 122.914 1.34 . . . . 40.0 111.751 -177.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.635 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.9 m-85 -127.72 158.08 38.59 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 107.75 -1.204 . . . . 40.0 107.75 178.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.429 ' HD2' ' CG2' ' A' ' 109' ' ' ILE . 6.0 ptmm? -127.08 142.64 51.47 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.056 -1.027 . . . . 40.0 112.124 -178.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.48 HG22 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.86 129.89 37.08 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.973 -1.491 . . . . 40.0 106.973 178.151 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 1.4 p -117.07 9.07 13.51 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 109.506 -0.553 . . . . 40.0 109.506 -177.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.543 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.97 33.4 5.25 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.584 -0.846 . . . . 40.0 109.772 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 64.58 66.27 0.6 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.042 -1.036 . . . . 40.0 110.826 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 60.7 42.74 13.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.479 -0.763 . . . . 40.0 110.408 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.543 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.2 mm-40 -115.53 -77.64 0.57 Allowed 'General case' 0 N--CA 1.509 2.49 0 O-C-N 120.701 -1.249 . . . . 40.0 109.551 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.514 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 19.7 p -93.03 121.1 34.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.606 -1.309 . . . . 40.0 110.177 -178.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.593 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 6.7 m-85 -102.33 83.7 2.36 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.644 -0.66 . . . . 40.0 110.911 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.1 m -76.35 144.35 40.18 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 122.106 0.955 . . . . 40.0 109.344 177.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.696 ' HZ1' ' C ' ' A' ' 110' ' ' ARG . 57.8 tttp -76.8 146.13 38.04 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 121.496 -0.753 . . . . 40.0 110.031 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.429 ' CG2' ' HD2' ' A' ' 98' ' ' LYS . 31.8 pt -127.61 -31.54 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 120.049 -0.66 . . . . 40.0 109.305 178.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.696 ' C ' ' HZ1' ' A' ' 108' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.501 2.121 0 N-CA-C 108.817 -0.809 . . . . 40.0 108.817 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.649 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.542 -0.54 . . . . 40.0 109.542 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.587 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.12 146.49 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.648 -0.658 . . . . 40.0 109.463 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -148.67 32.69 0.78 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.114 -0.991 . . . . 40.0 109.305 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.0 p -119.54 141.56 49.12 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.502 -0.879 . . . . 40.0 110.58 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.562 ' CE2' HG21 ' A' ' 76' ' ' ILE . 58.9 m-85 -41.84 -87.37 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 N-CA-C 113.486 0.921 . . . . 40.0 113.486 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.658 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -47.57 -46.16 27.75 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.316 -0.865 . . . . 40.0 109.878 -179.494 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.87 47.95 Favored Glycine 0 N--CA 1.497 2.708 0 N-CA-C 110.043 -1.223 . . . . 40.0 110.043 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.44 -43.88 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.124 -1.221 . . . . 40.0 109.368 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.828 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -57.2 -54.6 44.96 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.557 0.694 . . . . 40.0 109.785 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -49.18 67.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.558 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.1 t80 -51.81 -51.31 57.39 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.952 0.882 . . . . 40.0 109.309 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.603 HD21 ' HA ' ' A' ' 20' ' ' LEU . 66.0 mt -70.04 -45.77 66.46 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.725 -0.61 . . . . 40.0 111.463 -179.083 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -62.64 -24.2 67.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.853 -1.154 . . . . 40.0 110.568 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.5 m -101.66 -49.22 4.06 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 120.481 -1.387 . . . . 40.0 111.182 -178.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.55 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.4 m-85 -101.64 -14.05 17.57 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.525 -0.735 . . . . 40.0 110.784 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.536 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.8 m-70 61.78 -25.72 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.096 -1.002 . . . . 40.0 111.788 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.588 ' NZ ' ' OD2' ' A' ' 22' ' ' ASP . 0.4 OUTLIER -73.8 123.76 24.78 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.518 -1.364 . . . . 40.0 109.847 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.617 HD23 ' HD2' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -48.65 128.86 13.9 Favored Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.426 -0.796 . . . . 40.0 109.339 179.013 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.617 ' HD2' HD23 ' A' ' 20' ' ' LEU . 46.4 Cg_exo -37.62 131.28 0.72 Allowed 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.411 2.074 . . . . 40.0 112.08 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -63.34 78.4 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.838 0.828 . . . . 40.0 110.11 -179.108 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.649 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 170.26 14.44 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.861 -0.524 . . . . 40.0 110.759 -179.416 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.432 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.9 m-85 -114.17 164.82 13.36 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.84 0.829 . . . . 40.0 111.834 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.79 150.28 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.345 -0.847 . . . . 40.0 109.695 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.433 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 68.2 p -73.07 150.54 42.23 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.227 -0.92 . . . . 40.0 108.708 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.645 ' NZ ' ' OD1' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -48.29 -53.09 18.52 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.802 -1.185 . . . . 40.0 107.802 178.321 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.0 t -46.33 -62.2 1.46 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.445 -0.784 . . . . 40.0 110.714 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.433 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 36.1 mt-10 -50.73 -56.07 13.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.874 -1.141 . . . . 40.0 109.009 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.83 -51.07 59.26 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.264 -0.898 . . . . 40.0 109.768 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.79 -48.35 77.23 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.844 -0.535 . . . . 40.0 110.829 -179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -30.67 69.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.368 -0.833 . . . . 40.0 110.467 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.67 -18.49 64.28 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.17 -0.956 . . . . 40.0 108.759 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.585 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 130.6 -0.7 5.52 Favored Glycine 0 N--CA 1.503 3.157 0 C-N-CA 120.192 -1.004 . . . . 40.0 111.02 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -62.84 113.29 2.96 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.544 -1.563 . . . . 40.0 109.074 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -122.09 141.86 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.344 -0.847 . . . . 40.0 111.032 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.13 -47.32 86.78 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.18 -0.95 . . . . 40.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.5 p -78.52 49.95 0.91 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.735 -1.228 . . . . 40.0 109.258 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -174.27 -49.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.204 -0.665 . . . . 40.0 109.204 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.02 24.42 73.15 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.194 -1.562 . . . . 40.0 109.194 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.585 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.7 p-10 -57.18 130.17 45.0 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.762 -0.846 . . . . 40.0 108.803 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.746 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 6.2 tp -169.34 -56.81 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.932 -0.766 . . . . 40.0 108.932 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.46 -27.18 35.69 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.751 -1.218 . . . . 40.0 109.803 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.42 -66.14 0.81 Allowed 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.583 0.706 . . . . 40.0 109.629 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.0 m -69.06 -27.13 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.475 -0.766 . . . . 40.0 110.615 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.663 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -143.82 78.35 14.22 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.936 . . . . 40.0 108.494 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -59.42 54.15 0.07 OUTLIER 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 123.409 2.74 . . . . 40.0 113.644 -178.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.34 40.85 0.07 OUTLIER Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.505 -1.331 . . . . 40.0 110.39 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.663 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 26.8 tttt -120.72 148.66 43.65 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.265 -1.138 . . . . 40.0 110.403 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 4.4 m -120.86 132.0 54.73 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.115 -0.991 . . . . 40.0 110.726 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 1.7 mm -65.05 155.43 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 CA-C-O 122.55 1.167 . . . . 40.0 111.015 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.544 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.84 154.4 6.4 Favored Glycine 0 N--CA 1.483 1.798 0 N-CA-C 109.15 -1.58 . . . . 40.0 109.15 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.411 ' O ' HG22 ' A' ' 26' ' ' THR . . . 117.44 18.15 5.43 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 119.859 -1.162 . . . . 40.0 111.111 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.645 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -76.58 -170.13 1.44 Allowed 'General case' 0 C--O 1.192 -1.923 0 O-C-N 120.607 -1.525 . . . . 40.0 109.758 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.0 mm -132.84 138.25 52.21 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.024 0 CA-C-O 121.798 0.809 . . . . 40.0 110.257 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -149.92 149.0 29.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.757 -0.589 . . . . 40.0 110.021 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.694 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.59 -17.93 21.86 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.806 -0.559 . . . . 40.0 110.318 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.545 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.9 t30 66.59 27.07 9.68 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.127 -0.983 . . . . 40.0 111.666 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.694 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.0 OUTLIER -55.37 -31.61 61.92 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.2 -1.037 . . . . 40.0 108.2 178.096 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.435 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 21.6 mp0 -64.69 -8.37 14.33 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 108.999 -0.741 . . . . 40.0 108.999 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.15 43.76 98.05 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 110.28 -1.128 . . . . 40.0 110.28 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.654 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -91.8 -13.64 31.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.38 -1.07 . . . . 40.0 109.074 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.545 ' H ' HD21 ' A' ' 58' ' ' ASN . 25.0 mt -135.25 167.43 22.61 Favored Pre-proline 0 N--CA 1.499 1.991 0 N-CA-C 108.299 -1.0 . . . . 40.0 108.299 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.635 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 88.1 Cg_exo -47.21 141.95 12.59 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.595 1.53 . . . . 40.0 112.344 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.649 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.95 -166.9 11.58 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 110.448 -1.061 . . . . 40.0 110.448 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.561 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.8 pttm 172.96 -156.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 106.807 -1.553 . . . . 40.0 106.807 -178.294 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.43 ' O ' ' OG ' ' A' ' 67' ' ' SER . 57.0 p -75.42 86.44 2.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.656 -1.278 . . . . 40.0 107.901 177.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.561 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.15 99.19 0.31 Allowed Glycine 0 N--CA 1.498 2.802 0 N-CA-C 108.665 -1.774 . . . . 40.0 108.665 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.649 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 17.0 tpp180 -122.56 140.12 53.14 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.349 -1.089 . . . . 40.0 109.878 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.638 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 31.4 p -107.26 131.32 54.33 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 108.212 -1.033 . . . . 40.0 108.212 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.635 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.3 m95 -126.0 141.57 51.9 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.761 -0.776 . . . . 40.0 110.846 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.648 ' HB2' ' CZ ' ' A' ' 90' ' ' TYR . 0.4 OUTLIER -143.8 148.74 36.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.196 -0.94 . . . . 40.0 109.306 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.588 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -113.71 175.48 5.44 Favored 'General case' 0 C--N 1.31 -1.125 0 O-C-N 120.983 -1.073 . . . . 40.0 113.14 -178.715 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.544 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -161.44 139.29 9.18 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.654 -0.654 . . . . 40.0 110.584 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.637 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.17 154.42 39.81 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.5 -0.75 . . . . 40.0 110.232 -179.562 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.562 HG21 ' CE2' ' A' ' 7' ' ' PHE . 18.3 mm -138.11 152.61 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.174 -0.954 . . . . 40.0 109.381 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.514 HD22 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 56.64 56.29 5.68 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.04 0.447 . . . . 40.0 111.505 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.746 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 65.9 t80 -120.51 154.51 35.2 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.936 -1.102 . . . . 40.0 109.129 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.618 ' OG1' ' N ' ' A' ' 80' ' ' SER . 43.5 p -133.32 -79.49 0.48 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 122.036 0.922 . . . . 40.0 109.49 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.618 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.84 103.55 2.78 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 115.314 -0.857 . . . . 40.0 110.027 -179.092 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.79 -104.58 0.26 Allowed Glycine 0 N--CA 1.501 2.983 0 N-CA-C 108.713 -1.755 . . . . 40.0 108.713 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 15.3 t80 -125.93 -175.46 3.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.534 -0.98 . . . . 40.0 109.429 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.443 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.5 mtm180 -83.68 -149.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.804 . . . . 40.0 109.728 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.442 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.4 p30 -165.02 -134.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.108 -1.071 . . . . 40.0 108.108 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 29.9 p -116.0 -9.18 11.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.773 -1.204 . . . . 40.0 109.978 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.637 ' OD1' HG22 ' A' ' 100' ' ' THR . 23.9 m-20 -74.33 108.77 7.32 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 122.195 -0.316 . . . . 40.0 110.558 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.829 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.07 137.07 42.52 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.114 -0.991 . . . . 40.0 110.422 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.63 HD11 HG21 ' A' ' 96' ' ' ILE . 14.6 tt -106.98 146.51 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 CA-C-O 122.108 0.956 . . . . 40.0 110.858 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.54 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.8 mm? -124.32 129.78 51.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 40.0 108.808 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.648 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 21.8 p90 -132.65 142.03 48.91 Favored 'General case' 0 N--CA 1.515 2.792 0 N-CA-C 109.528 -0.545 . . . . 40.0 109.528 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.585 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.8 p -108.07 -178.71 3.69 Favored 'General case' 0 N--CA 1.506 2.349 0 CA-C-O 122.248 1.023 . . . . 40.0 113.109 -176.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.638 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.12 -52.66 57.96 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.502 1.144 . . . . 40.0 108.45 178.31 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.55 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -67.67 3.72 1.32 Allowed 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.348 -1.297 . . . . 40.0 110.116 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.484 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 73.2 m95 71.55 15.48 6.07 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.823 -0.548 . . . . 40.0 111.789 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.518 ' HA ' HD23 ' A' ' 95' ' ' LEU . 21.0 mt -69.38 127.39 32.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.26 -1.525 . . . . 40.0 106.916 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.828 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mp -113.13 135.33 52.98 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 CA-C-O 122.824 1.297 . . . . 40.0 111.347 -177.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.543 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 14.0 m-85 -127.33 159.8 33.3 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.938 -1.504 . . . . 40.0 106.938 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.456 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 4.5 ptmm? -128.45 142.8 50.98 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 119.028 -1.069 . . . . 40.0 112.731 -178.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 131.77 40.84 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 107.616 -1.253 . . . . 40.0 107.616 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.637 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.7 p -116.82 9.52 13.92 Favored 'General case' 0 N--CA 1.51 2.551 0 N-CA-C 109.699 -0.482 . . . . 40.0 109.699 -177.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.617 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -114.72 36.2 3.93 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.496 -0.882 . . . . 40.0 109.341 179.196 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.69 69.32 0.69 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.15 -0.968 . . . . 40.0 110.977 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 58.92 45.87 14.54 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.449 -0.782 . . . . 40.0 110.445 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.617 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 31.5 mm-40 -118.82 -78.73 0.59 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.742 -1.224 . . . . 40.0 109.083 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.521 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.0 p -93.84 121.95 35.82 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 120.849 -1.157 . . . . 40.0 110.183 -178.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.543 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -102.91 84.15 2.33 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.571 -0.706 . . . . 40.0 110.881 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.4 m -77.77 142.29 38.75 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.822 -1.174 . . . . 40.0 108.977 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.543 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 60.7 tttp -75.08 144.93 42.71 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.856 -0.528 . . . . 40.0 110.705 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.652 HD11 HG22 ' A' ' 96' ' ' ILE . 26.9 pt -127.49 -28.86 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 109.166 -0.679 . . . . 40.0 109.166 177.563 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.658 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.066 0 N-CA-C 108.861 -0.792 . . . . 40.0 108.861 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.685 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.0 t . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.347 -0.612 . . . . 40.0 109.347 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.604 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.7 mt -139.01 146.06 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.373 -0.83 . . . . 40.0 109.709 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.9 p-10 -147.52 32.88 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.089 -1.007 . . . . 40.0 109.765 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -118.87 140.94 49.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.949 0.88 . . . . 40.0 110.287 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.505 ' CE2' HG21 ' A' ' 76' ' ' ILE . 60.0 m-85 -41.17 -85.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 113.033 0.753 . . . . 40.0 113.033 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.642 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -48.37 -45.66 35.94 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.744 -0.598 . . . . 40.0 109.851 -178.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.74 -52.11 31.01 Favored Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.495 -1.042 . . . . 40.0 110.495 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 51.3 t -65.77 -45.08 92.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -1.211 . . . . 40.0 109.726 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 1.051 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.06 -56.98 15.03 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.626 0.727 . . . . 40.0 110.168 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.49 -49.58 67.19 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.965 -0.754 . . . . 40.0 108.965 178.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.633 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 16.6 t80 -51.85 -50.85 60.12 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.179 0.99 . . . . 40.0 109.02 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.56 HD22 ' HZ3' ' A' ' 94' ' ' TRP . 29.3 mt -66.37 -47.16 74.29 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 115.918 -0.583 . . . . 40.0 110.713 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.429 ' HG3' HD11 ' A' ' 96' ' ' ILE . 23.0 mt-30 -64.13 -21.67 66.64 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.196 -0.94 . . . . 40.0 111.531 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.2 m -105.11 -46.02 4.36 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.875 -1.14 . . . . 40.0 111.811 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.577 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.5 m-85 -100.37 -17.12 17.38 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.145 -0.972 . . . . 40.0 110.919 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.5 m-70 61.97 -29.02 0.07 Allowed 'General case' 0 N--CA 1.505 2.3 0 CA-C-O 121.668 0.746 . . . . 40.0 111.282 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.633 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.47 115.96 12.36 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 120.93 -1.106 . . . . 40.0 108.741 179.503 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.647 HD23 ' HD2' ' A' ' 21' ' ' PRO . 0.9 OUTLIER -42.9 129.92 3.16 Favored Pre-proline 0 N--CA 1.5 2.029 0 N-CA-C 108.846 -0.798 . . . . 40.0 108.846 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.647 ' HD2' HD23 ' A' ' 20' ' ' LEU . 74.2 Cg_exo -35.47 134.82 0.21 Allowed 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.741 2.294 . . . . 40.0 112.94 -179.069 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.59 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -64.32 73.86 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 121.862 0.839 . . . . 40.0 110.302 -179.011 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.685 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 172.19 16.34 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.606 -0.684 . . . . 40.0 111.367 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.518 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 12.5 m-85 -113.57 164.64 13.39 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.311 -0.868 . . . . 40.0 111.034 -178.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -153.91 149.94 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.333 -0.855 . . . . 40.0 109.562 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.2 p -70.6 151.38 45.06 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.671 -0.643 . . . . 40.0 109.509 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.659 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -50.58 -51.76 45.35 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 107.715 -1.217 . . . . 40.0 107.715 177.226 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -47.14 -61.85 1.69 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.614 -0.679 . . . . 40.0 110.473 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -49.76 -57.13 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.089 -1.007 . . . . 40.0 108.939 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.93 58.9 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-O 121.632 0.73 . . . . 40.0 109.656 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -64.34 -48.22 76.37 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.829 -0.544 . . . . 40.0 110.985 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.32 -31.08 70.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.259 -0.901 . . . . 40.0 109.957 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.8 -20.11 65.88 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.187 -0.945 . . . . 40.0 108.951 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.564 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 130.99 -1.89 5.5 Favored Glycine 0 N--CA 1.501 2.986 0 N-CA-C 110.863 -0.895 . . . . 40.0 110.863 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -60.07 116.52 4.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.585 -1.538 . . . . 40.0 109.034 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 43.2 t -123.88 143.7 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 CA-C-O 121.735 0.778 . . . . 40.0 110.523 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.8 77.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.244 -0.91 . . . . 40.0 109.812 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.9 p -79.16 51.08 1.13 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.86 -1.15 . . . . 40.0 109.06 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -173.3 -50.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 108.924 -0.769 . . . . 40.0 108.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.39 21.68 72.51 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 108.805 -1.718 . . . . 40.0 108.805 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.564 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -56.79 132.02 51.04 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.85 -0.794 . . . . 40.0 109.059 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.565 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 6.1 tp -169.97 -57.2 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.995 -1.113 . . . . 40.0 107.995 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.22 -23.75 49.96 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.683 -0.636 . . . . 40.0 110.768 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.425 ' OD2' HG13 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -76.86 -64.41 1.13 Allowed 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.709 -0.849 . . . . 40.0 108.709 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.425 HG13 ' OD2' ' A' ' 44' ' ' ASP . 27.5 m -68.87 -27.05 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.534 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -144.62 79.69 12.22 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.571 -0.705 . . . . 40.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -59.26 55.88 0.06 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.713 2.275 . . . . 40.0 114.105 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.95 43.83 0.06 OUTLIER Glycine 0 N--CA 1.502 3.039 0 C-N-CA 120.104 -1.046 . . . . 40.0 111.152 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 19.2 tttt -122.89 146.18 47.8 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.771 -1.429 . . . . 40.0 109.585 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.6 m -116.21 136.97 52.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 40.0 109.808 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.429 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 7.4 mm -66.49 151.86 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 CA-C-O 121.241 0.543 . . . . 40.0 109.606 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 150.41 145.72 4.18 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 118.924 -1.607 . . . . 40.0 110.88 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.77 15.86 3.13 Favored Glycine 0 N--CA 1.494 2.56 0 O-C-N 121.305 -1.115 . . . . 40.0 111.388 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.659 ' CG ' ' HZ2' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -72.11 -169.65 0.52 Allowed 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.151 -1.205 . . . . 40.0 110.356 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.401 HG12 ' C ' ' A' ' 54' ' ' ASP . 1.1 mm -133.49 138.14 51.61 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.62 0 CA-C-O 121.459 0.647 . . . . 40.0 109.627 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -150.41 146.84 26.93 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.426 -0.796 . . . . 40.0 109.63 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.686 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -91.16 -21.83 20.97 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.691 -0.631 . . . . 40.0 110.174 179.737 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.605 HD21 ' H ' ' A' ' 63' ' ' LEU . 64.6 t30 72.33 26.69 2.62 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.265 -0.897 . . . . 40.0 111.588 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.686 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.2 mtm-85 -55.32 -31.86 62.01 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.969 -1.082 . . . . 40.0 108.461 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.432 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.2 mp0 -62.9 -10.48 13.58 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.063 -0.717 . . . . 40.0 109.063 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.27 45.42 96.51 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 110.402 -1.079 . . . . 40.0 110.402 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.649 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.28 -13.21 25.04 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.579 -0.953 . . . . 40.0 109.741 -179.785 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.615 HD21 ' CD2' ' A' ' 106' ' ' PHE . 24.7 mt -136.77 163.72 47.56 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.15 -1.056 . . . . 40.0 108.15 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.471 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 91.5 Cg_exo -42.62 141.59 2.31 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 122.449 2.099 . . . . 40.0 112.814 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.468 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.97 -171.02 12.71 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 110.788 -0.925 . . . . 40.0 110.788 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.439 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 ptmm? 177.09 -157.77 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.213 -1.403 . . . . 40.0 107.213 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' OG ' ' A' ' 67' ' ' SER . 53.1 p -75.08 84.91 2.32 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 107.134 -1.432 . . . . 40.0 107.134 177.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.439 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.91 99.33 0.35 Allowed Glycine 0 N--CA 1.497 2.726 0 N-CA-C 108.954 -1.658 . . . . 40.0 108.954 -178.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.606 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.1 tpp180 -121.14 142.68 49.64 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.587 -0.949 . . . . 40.0 110.175 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.638 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.99 128.66 55.14 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.341 -0.985 . . . . 40.0 108.341 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.531 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 34.5 m95 -120.54 142.3 49.46 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.062 -1.024 . . . . 40.0 110.814 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.594 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.2 mpp_? -141.22 146.89 37.47 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.462 -0.773 . . . . 40.0 109.986 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.641 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -116.72 169.84 9.05 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 121.184 -0.948 . . . . 40.0 111.983 -179.87 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.518 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -157.49 145.31 18.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.561 -0.712 . . . . 40.0 109.747 178.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.645 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.24 154.63 41.69 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.524 -0.735 . . . . 40.0 109.474 -178.922 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.505 HG21 ' CE2' ' A' ' 7' ' ' PHE . 15.0 mm -137.34 149.9 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.103 -0.998 . . . . 40.0 109.653 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.471 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.6 m-20 59.69 57.11 3.32 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.144 0.497 . . . . 40.0 111.016 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.565 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 60.6 t80 -121.51 153.83 37.44 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.17 -0.956 . . . . 40.0 109.025 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.61 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.0 p -132.29 -79.81 0.5 Allowed 'General case' 0 N--CA 1.5 2.03 0 CA-C-O 121.833 0.825 . . . . 40.0 109.937 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.61 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.99 99.92 2.59 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 108.723 -0.843 . . . . 40.0 108.723 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.17 -107.71 0.34 Allowed Glycine 0 N--CA 1.496 2.655 0 N-CA-C 109.953 -1.259 . . . . 40.0 109.953 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.471 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 19.5 t80 -123.43 -178.98 4.16 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.343 -1.093 . . . . 40.0 110.299 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.471 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -83.28 -153.45 0.13 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.744 0.783 . . . . 40.0 110.306 -179.249 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.413 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.7 p30 -162.92 -133.66 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.356 -0.979 . . . . 40.0 108.356 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 100' ' ' THR . 52.9 p -115.39 -10.35 12.01 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.997 -1.064 . . . . 40.0 109.706 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.606 ' OD1' HG22 ' A' ' 100' ' ' THR . 14.1 m-20 -72.57 108.3 5.54 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 120.834 0.35 . . . . 40.0 110.078 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.789 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.02 137.61 41.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.124 -1.03 . . . . 40.0 110.502 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.638 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.6 tt -107.99 148.01 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 122.509 1.147 . . . . 40.0 110.896 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.638 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -125.48 127.3 46.27 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.704 -0.85 . . . . 40.0 108.704 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.594 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.9 p90 -131.48 141.38 49.76 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.682 -0.858 . . . . 40.0 108.682 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.531 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 61.7 p -107.3 178.73 4.46 Favored 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 122.114 0.959 . . . . 40.0 112.155 -177.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.638 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -50.7 -54.04 26.41 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.37 1.081 . . . . 40.0 108.526 177.381 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.606 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -66.02 3.56 0.82 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.694 -1.139 . . . . 40.0 110.389 -179.153 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.56 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 64.9 m95 72.44 13.35 5.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.711 -0.618 . . . . 40.0 111.935 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.47 127.16 31.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 119.896 -1.752 . . . . 40.0 107.428 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 1.051 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mt -114.24 132.8 62.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-O 122.552 1.168 . . . . 40.0 112.529 -177.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.487 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.4 m-85 -125.26 157.08 37.49 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 114.335 -1.302 . . . . 40.0 107.564 178.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.424 ' NZ ' ' CZ ' ' A' ' 7' ' ' PHE . 5.6 ptmm? -128.03 141.54 51.48 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.027 -1.069 . . . . 40.0 112.36 -177.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.423 ' HB ' ' O ' ' A' ' 105' ' ' THR . 0.0 OUTLIER -131.1 132.66 44.99 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 107.128 -1.434 . . . . 40.0 107.128 177.248 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.606 HG22 ' OD1' ' A' ' 86' ' ' ASP . 2.8 p -117.89 9.3 12.83 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 109.449 -0.574 . . . . 40.0 109.449 -178.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.531 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.63 35.11 4.19 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 119.672 -0.811 . . . . 40.0 109.765 179.16 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.13 68.05 0.76 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.21 -0.931 . . . . 40.0 111.036 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 60.53 42.57 14.04 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.793 -0.567 . . . . 40.0 110.778 178.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.531 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.9 mm-40 -114.63 -76.95 0.57 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.732 -1.23 . . . . 40.0 109.655 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.486 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.0 p -93.83 126.03 38.79 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.622 -1.299 . . . . 40.0 110.669 -178.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.615 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.8 m-85 -105.85 85.98 2.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.593 -0.692 . . . . 40.0 110.807 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.5 m -77.89 144.87 36.57 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.25 -0.98 . . . . 40.0 108.793 177.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 58.8 tttp -77.21 147.92 36.15 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.609 -0.682 . . . . 40.0 110.151 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.747 HD11 ' CG2' ' A' ' 96' ' ' ILE . 23.2 pt -127.21 -35.46 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 N-CA-C 108.443 -0.947 . . . . 40.0 108.443 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.642 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.11 0 O-C-N 121.565 -0.709 . . . . 40.0 109.576 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.655 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.3 t . . . . . 0 N--CA 1.494 1.765 0 N-CA-C 109.132 -0.692 . . . . 40.0 109.132 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.571 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 9.5 mt -135.78 147.22 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.473 -0.767 . . . . 40.0 109.599 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -147.73 29.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.99 -1.068 . . . . 40.0 109.734 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.4 p -116.48 143.05 46.07 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 119.68 -0.808 . . . . 40.0 110.732 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.514 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 59.7 m-85 -42.95 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.372 0 N-CA-C 112.781 0.66 . . . . 40.0 112.781 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.622 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.0 OUTLIER -47.59 -47.23 28.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.583 -0.698 . . . . 40.0 110.135 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.24 -50.91 38.4 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.52 -1.032 . . . . 40.0 110.52 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.2 t -65.58 -46.38 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.097 -1.237 . . . . 40.0 109.426 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.994 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.71 -57.1 13.88 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.417 -0.802 . . . . 40.0 110.246 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.08 -51.36 58.13 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 108.904 -0.776 . . . . 40.0 108.904 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.644 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.0 t80 -51.12 -49.93 59.82 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.969 0.89 . . . . 40.0 109.781 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.607 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 34.7 mt -68.25 -45.5 73.03 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.623 -0.673 . . . . 40.0 110.118 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.4 ' HG3' HD11 ' A' ' 96' ' ' ILE . 24.4 mt-30 -65.27 -19.12 65.82 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.387 -0.925 . . . . 40.0 111.744 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.9 m -107.52 -44.01 4.39 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.766 -1.209 . . . . 40.0 110.821 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.594 ' O ' ' N ' ' A' ' 19' ' ' LYS . 83.9 m-85 -104.52 -14.44 15.67 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 40.0 111.615 -177.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.607 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.3 m-70 59.54 -33.44 0.06 Allowed 'General case' 0 N--CA 1.51 2.549 0 CA-C-O 121.288 0.566 . . . . 40.0 111.483 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.644 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -68.68 120.85 15.32 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.758 -1.214 . . . . 40.0 108.233 179.481 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.541 ' HA ' HD21 ' A' ' 14' ' ' LEU . 3.4 mt -48.13 133.02 12.34 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.335 -0.853 . . . . 40.0 109.398 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.458 ' O ' ' N ' ' A' ' 23' ' ' ASN . 78.7 Cg_exo -35.82 132.36 0.29 Allowed 'Trans proline' 0 C--N 1.313 -1.341 0 C-N-CA 122.732 2.288 . . . . 40.0 112.889 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.557 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.3 OUTLIER -63.48 74.8 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.955 0.883 . . . . 40.0 109.732 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.655 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 172.42 15.68 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.655 -0.653 . . . . 40.0 110.577 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -114.93 162.94 16.26 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.747 0.784 . . . . 40.0 111.095 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -149.38 151.4 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.086 -1.009 . . . . 40.0 109.698 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.477 HG22 ' O ' ' A' ' 53' ' ' GLY . 77.7 p -71.57 149.64 45.48 Favored 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 109.049 -0.723 . . . . 40.0 109.049 177.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.623 ' NZ ' ' OD2' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -48.77 -53.67 18.14 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.196 -1.039 . . . . 40.0 108.196 177.812 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.2 t -45.58 -63.19 1.01 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.739 -0.6 . . . . 40.0 110.415 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.436 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 44.5 mt-10 -49.42 -57.12 7.52 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.54 -0.725 . . . . 40.0 109.357 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.01 -48.49 70.38 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.324 -0.86 . . . . 40.0 109.91 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.408 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 57.0 mt-30 -64.43 -48.74 74.18 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 40.0 110.192 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.18 70.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 40.0 110.46 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.68 -20.35 66.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.288 -0.883 . . . . 40.0 109.209 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.566 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 132.73 -4.04 5.04 Favored Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.942 -1.123 . . . . 40.0 111.106 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -61.2 114.39 3.12 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.709 -1.465 . . . . 40.0 109.098 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.7 t -121.93 143.0 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-O 121.799 0.809 . . . . 40.0 110.626 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.08 -47.58 84.03 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.642 -0.661 . . . . 40.0 110.243 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.2 p -79.13 50.15 1.02 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.064 -1.022 . . . . 40.0 108.997 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -174.25 -51.55 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.115 -0.698 . . . . 40.0 109.115 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.63 23.76 75.4 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.566 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.1 p-10 -56.51 130.11 43.64 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.838 -0.801 . . . . 40.0 108.967 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.663 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.4 tp -168.26 -60.05 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.997 -0.742 . . . . 40.0 108.997 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . . . -56.32 -23.64 38.44 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.312 -0.868 . . . . 40.0 109.808 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -65.06 0.98 Allowed 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.916 -0.772 . . . . 40.0 108.916 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.49 -26.76 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-O 121.468 0.652 . . . . 40.0 109.553 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.517 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -144.65 78.64 12.88 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.32 -0.862 . . . . 40.0 109.873 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 43' ' ' ALA . 20.0 Cg_exo -57.49 52.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.497 1.728 0 C-N-CA 122.847 2.364 . . . . 40.0 114.238 -178.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.34 42.92 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 C-N-CA 119.565 -1.302 . . . . 40.0 111.262 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.517 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 10.6 tttt -121.71 144.5 48.75 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.26 . . . . 40.0 109.996 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.0 m -116.25 132.18 56.74 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.177 -0.952 . . . . 40.0 109.941 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.483 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.8 mm -63.89 150.86 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.342 -0.849 . . . . 40.0 110.099 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 152.77 151.61 5.73 Favored Glycine 0 N--CA 1.502 3.048 0 C-N-CA 119.798 -1.191 . . . . 40.0 110.472 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.477 ' O ' HG22 ' A' ' 26' ' ' THR . . . 118.82 18.2 4.83 Favored Glycine 0 N--CA 1.497 2.709 0 O-C-N 121.177 -1.19 . . . . 40.0 110.865 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.623 ' OD2' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -75.78 -169.93 1.2 Allowed 'General case' 0 C--O 1.191 -1.987 0 O-C-N 121.182 -1.187 . . . . 40.0 109.537 179.768 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.8 mm -133.81 142.1 42.29 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.906 0 CA-C-O 121.726 0.774 . . . . 40.0 109.945 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -154.51 146.85 23.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.696 -0.627 . . . . 40.0 109.53 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.685 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -93.39 -19.38 21.37 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.431 -0.793 . . . . 40.0 110.874 -179.762 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.535 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.8 t30 69.15 30.14 4.45 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.115 -0.99 . . . . 40.0 111.825 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.685 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.86 -31.69 65.07 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.966 -1.084 . . . . 40.0 108.43 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.456 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.0 mp0 -63.47 -11.54 24.51 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 63.24 41.23 99.64 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.153 -1.179 . . . . 40.0 110.153 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.653 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -91.6 -13.81 31.3 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.446 -1.032 . . . . 40.0 109.157 179.706 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.535 ' H ' HD21 ' A' ' 58' ' ' ASN . 30.8 mt -135.72 163.37 51.01 Favored Pre-proline 0 N--CA 1.494 1.762 0 N-CA-C 108.579 -0.897 . . . . 40.0 108.579 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.631 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 85.4 Cg_exo -43.21 140.11 3.72 Favored 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 121.915 1.744 . . . . 40.0 112.239 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.619 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.16 -165.8 11.4 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.819 -1.312 . . . . 40.0 109.819 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.499 ' HB3' ' NH2' ' A' ' 69' ' ' ARG . 1.4 pttm 171.45 -154.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 107.6 -1.259 . . . . 40.0 107.6 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' A' ' 67' ' ' SER . 17.6 p -74.57 81.91 2.0 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.245 -1.391 . . . . 40.0 107.245 176.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.429 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.85 105.19 0.21 Allowed Glycine 0 N--CA 1.499 2.872 0 N-CA-C 108.762 -1.735 . . . . 40.0 108.762 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.621 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -126.53 141.52 51.84 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.654 -0.909 . . . . 40.0 110.155 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.641 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 27.8 p -108.71 130.13 55.36 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.955 -0.757 . . . . 40.0 108.955 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.631 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 33.5 m95 -121.78 146.24 47.25 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 119.522 -0.871 . . . . 40.0 110.895 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.54 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.8 OUTLIER -147.13 140.77 25.65 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.095 -1.003 . . . . 40.0 109.314 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.604 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -111.85 164.59 12.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.0 -1.062 . . . . 40.0 111.17 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . . . -151.41 147.12 26.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.693 -0.63 . . . . 40.0 109.62 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.639 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.51 155.8 40.23 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.097 -1.002 . . . . 40.0 110.583 -178.503 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.514 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 17.0 mm -139.19 151.81 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.255 -0.903 . . . . 40.0 110.147 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.566 HD22 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 57.96 53.88 6.49 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.311 0.577 . . . . 40.0 111.096 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.663 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 61.5 t80 -118.32 153.78 33.41 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.314 -0.866 . . . . 40.0 108.997 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.9 p -132.8 -79.09 0.49 Allowed 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.739 0.781 . . . . 40.0 109.765 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.26 101.83 2.72 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 109.387 -0.597 . . . . 40.0 109.387 -178.918 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -104.99 0.27 Allowed Glycine 0 N--CA 1.5 2.913 0 N-CA-C 109.643 -1.383 . . . . 40.0 109.643 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.478 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 23.1 t80 -125.85 -178.0 4.13 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.522 -0.987 . . . . 40.0 109.882 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 3.0 mtm180 -83.55 -152.02 0.12 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.43 -0.793 . . . . 40.0 110.456 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.421 HD21 ' HB2' ' A' ' 86' ' ' ASP . 38.4 p-10 -164.01 -132.58 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.686 -0.857 . . . . 40.0 108.686 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 100' ' ' THR . 15.4 p -116.48 -9.63 11.4 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.199 -0.938 . . . . 40.0 109.575 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.65 ' OD1' HG22 ' A' ' 100' ' ' THR . 12.6 m-20 -75.01 108.99 8.1 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-N 116.4 -0.364 . . . . 40.0 110.758 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.824 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.57 140.14 44.42 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.232 -0.917 . . . . 40.0 110.395 179.393 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.662 ' O ' HD22 ' A' ' 89' ' ' LEU . 11.8 tt -108.57 148.98 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-O 122.533 1.159 . . . . 40.0 110.341 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.662 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.9 mm? -126.94 124.65 39.99 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.431 -0.951 . . . . 40.0 108.431 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.3 p90 -128.36 141.38 51.44 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 108.968 -0.753 . . . . 40.0 108.968 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.573 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 59.4 p -107.51 -178.4 3.62 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.083 -1.01 . . . . 40.0 112.017 -176.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.641 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.58 -55.81 22.54 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.403 1.097 . . . . 40.0 108.34 177.464 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.621 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -64.63 5.28 0.31 Allowed 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 114.419 -1.264 . . . . 40.0 110.388 -179.187 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.469 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 66.3 m95 70.46 14.65 7.36 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.74 -0.6 . . . . 40.0 111.856 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 95' ' ' LEU . 26.8 mt -68.42 127.89 34.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 119.66 -1.9 . . . . 40.0 106.719 177.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.994 HD13 ' HB1' ' A' ' 11' ' ' ALA . 3.0 mt -115.96 134.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 CA-C-O 122.803 1.287 . . . . 40.0 111.602 -177.419 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.429 ' CE1' ' HG2' ' A' ' 64' ' ' PRO . 13.9 m-85 -126.91 157.22 39.98 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.269 -1.382 . . . . 40.0 107.269 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.435 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.3 144.75 50.99 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 118.929 -1.108 . . . . 40.0 112.39 -178.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.425 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.17 132.68 38.28 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.772 -1.195 . . . . 40.0 107.772 177.631 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.65 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.2 p -117.87 9.2 12.82 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-O 120.91 0.386 . . . . 40.0 109.973 -177.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.602 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.99 33.18 5.38 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.768 -0.773 . . . . 40.0 109.973 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 63.17 70.13 0.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.975 -1.078 . . . . 40.0 110.362 178.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 56.49 48.33 16.99 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.52 -0.737 . . . . 40.0 109.835 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.602 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 27.3 mm-40 -120.0 -77.71 0.58 Allowed 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.724 -1.235 . . . . 40.0 109.339 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.557 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 17.7 p -94.78 120.58 35.23 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.724 -1.235 . . . . 40.0 110.155 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.512 ' CD1' ' N ' ' A' ' 106' ' ' PHE . 5.7 m-85 -102.28 86.4 2.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.417 -0.802 . . . . 40.0 110.545 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.4 m -79.13 146.9 32.92 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.199 -0.938 . . . . 40.0 109.036 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.503 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 58.0 tttp -78.04 146.87 35.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.796 -0.565 . . . . 40.0 110.41 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.741 HD11 ' CG2' ' A' ' 96' ' ' ILE . 22.4 pt -128.98 -32.0 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 N-CA-C 109.126 -0.694 . . . . 40.0 109.126 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.622 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 108.493 -0.929 . . . . 40.0 108.493 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.687 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.6 t . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.647 -0.501 . . . . 40.0 109.647 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.531 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -137.88 148.93 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.243 -0.911 . . . . 40.0 109.065 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -149.05 34.03 0.74 Allowed 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.209 -0.932 . . . . 40.0 109.798 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 24.4 p -120.09 142.91 48.45 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 119.635 -0.826 . . . . 40.0 110.56 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.584 ' CE2' HG21 ' A' ' 76' ' ' ILE . 68.8 m-85 -43.28 -84.98 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 CA-C-O 121.952 0.882 . . . . 40.0 112.573 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.629 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.6 OUTLIER -45.82 -47.56 15.8 Favored 'General case' 0 C--N 1.283 -2.298 0 O-C-N 121.853 -0.529 . . . . 40.0 110.035 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.62 -49.92 50.96 Favored Glycine 0 N--CA 1.502 3.048 0 N-CA-C 110.331 -1.108 . . . . 40.0 110.331 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -66.17 -43.97 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.224 -1.162 . . . . 40.0 108.562 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.84 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.86 -58.33 8.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.252 -0.905 . . . . 40.0 109.388 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.05 -49.38 63.58 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.368 0.604 . . . . 40.0 109.605 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.612 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.6 t80 -53.67 -48.96 68.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.011 0.91 . . . . 40.0 109.65 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.578 HD21 ' HA ' ' A' ' 20' ' ' LEU . 29.9 mt -69.63 -46.12 66.93 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.805 -0.559 . . . . 40.0 110.658 -178.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -64.72 -22.11 66.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.429 -0.794 . . . . 40.0 110.875 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 m -103.25 -43.89 5.33 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.643 -1.286 . . . . 40.0 111.851 -178.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.558 ' O ' ' N ' ' A' ' 19' ' ' LYS . 86.2 m-85 -107.51 -12.6 15.26 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.168 -0.957 . . . . 40.0 111.005 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.54 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 60.56 -30.9 0.06 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.975 -0.453 . . . . 40.0 111.817 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.612 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -69.69 117.48 11.34 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.936 -1.103 . . . . 40.0 108.583 179.254 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.578 ' HA ' HD21 ' A' ' 14' ' ' LEU . 3.3 mt -44.92 131.75 5.26 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.476 -0.765 . . . . 40.0 109.151 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.509 ' HD2' HD23 ' A' ' 20' ' ' LEU . 71.3 Cg_exo -34.59 132.72 0.17 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.782 2.321 . . . . 40.0 112.549 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.561 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -63.49 74.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.59 0.709 . . . . 40.0 110.479 -179.313 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.687 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 172.37 18.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.578 -0.701 . . . . 40.0 110.681 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -116.57 160.96 19.9 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.52 -0.738 . . . . 40.0 110.978 -178.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.52 152.58 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.249 -0.907 . . . . 40.0 109.151 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.456 HG22 ' O ' ' A' ' 53' ' ' GLY . 72.9 p -71.5 151.01 44.3 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.367 0.603 . . . . 40.0 110.093 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -50.67 -51.75 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.74 -1.207 . . . . 40.0 107.74 177.251 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.9 t -47.13 -62.13 1.56 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.282 -0.886 . . . . 40.0 110.232 178.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -48.53 -58.67 4.33 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.288 -0.883 . . . . 40.0 109.162 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.26 -49.42 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 121.562 0.696 . . . . 40.0 110.067 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -65.07 -50.09 67.49 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.371 0.605 . . . . 40.0 110.32 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.1 -30.36 70.36 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.434 -0.791 . . . . 40.0 110.16 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.9 mt -68.22 -19.69 64.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 40.0 109.215 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.537 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.85 -2.19 5.18 Favored Glycine 0 N--CA 1.5 2.922 0 C-N-CA 119.847 -1.168 . . . . 40.0 111.221 178.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -62.56 113.79 3.17 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.697 -1.472 . . . . 40.0 109.047 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -121.69 144.91 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 40.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.79 85.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.442 -0.786 . . . . 40.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.2 p -79.18 52.17 1.27 Allowed 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.266 -1.013 . . . . 40.0 108.266 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -174.83 -52.26 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 109.261 -0.644 . . . . 40.0 109.261 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.65 22.94 76.88 Favored Glycine 0 N--CA 1.5 2.954 0 N-CA-C 109.38 -1.488 . . . . 40.0 109.38 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.537 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.0 p-10 -59.78 126.51 27.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.58 -0.953 . . . . 40.0 110.304 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.504 HD11 HD11 ' A' ' 51' ' ' ILE . 0.9 OUTLIER -165.53 -57.59 0.03 OUTLIER 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.552 -0.907 . . . . 40.0 108.552 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.463 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . . . -53.93 -29.14 41.04 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.264 -0.897 . . . . 40.0 109.865 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -63.0 1.37 Allowed 'General case' 0 N--CA 1.504 2.228 0 CA-C-O 121.553 0.692 . . . . 40.0 109.732 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.6 m -71.1 -23.76 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.409 -0.807 . . . . 40.0 110.403 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.606 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.78 76.38 9.75 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.153 -0.967 . . . . 40.0 109.461 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 43' ' ' ALA . 2.8 Cg_exo -61.82 57.28 0.12 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.213 1.942 . . . . 40.0 113.097 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 146.62 36.18 0.06 OUTLIER Glycine 0 N--CA 1.504 3.179 0 N-CA-C 110.71 -0.956 . . . . 40.0 110.71 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.606 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 9.4 tttt -118.48 144.14 46.22 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.724 -1.457 . . . . 40.0 109.995 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.8 m -117.02 134.36 54.85 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.217 -0.927 . . . . 40.0 109.314 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.504 HD11 HD11 ' A' ' 42' ' ' LEU . 8.7 mm -65.01 148.41 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 CA-C-O 121.675 0.75 . . . . 40.0 109.719 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.81 145.34 4.12 Favored Glycine 0 N--CA 1.494 2.529 0 C-N-CA 119.002 -1.57 . . . . 40.0 111.151 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.456 ' O ' HG22 ' A' ' 26' ' ' THR . . . 124.14 17.52 3.0 Favored Glycine 0 N--CA 1.494 2.564 0 C-N-CA 119.986 -1.102 . . . . 40.0 111.11 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.565 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -73.33 -166.58 0.34 Allowed 'General case' 0 C--O 1.196 -1.713 0 O-C-N 120.844 -1.386 . . . . 40.0 109.908 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -134.72 140.48 45.5 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.688 0 CA-C-O 121.555 0.693 . . . . 40.0 109.826 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -152.26 146.35 25.35 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.542 -0.724 . . . . 40.0 109.727 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.679 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.23 -18.37 21.75 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.497 -0.752 . . . . 40.0 110.529 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.603 HD21 ' H ' ' A' ' 63' ' ' LEU . 63.3 t30 69.3 29.04 4.67 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.113 -0.992 . . . . 40.0 111.633 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.679 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.45 -30.83 63.35 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.039 -1.038 . . . . 40.0 108.213 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 24.5 mp0 -64.75 -10.3 26.6 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.369 -0.604 . . . . 40.0 109.369 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.29 44.89 97.03 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.031 -1.228 . . . . 40.0 110.031 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.667 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -94.95 -13.16 25.6 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.603 -0.939 . . . . 40.0 109.249 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.623 HD21 ' CD2' ' A' ' 106' ' ' PHE . 24.3 mt -135.18 164.05 46.63 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 108.378 -0.971 . . . . 40.0 108.378 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.546 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 94.8 Cg_exo -44.08 138.13 6.82 Favored 'Trans proline' 0 N--CA 1.495 1.595 0 C-N-CA 121.83 1.687 . . . . 40.0 112.006 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.608 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.15 -167.4 11.94 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 110.205 -1.158 . . . . 40.0 110.205 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.514 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.2 pttm 173.7 -158.67 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.15 -1.426 . . . . 40.0 107.15 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.46 ' O ' ' OG ' ' A' ' 67' ' ' SER . 32.6 p -73.6 92.29 1.93 Allowed 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.371 -1.344 . . . . 40.0 107.371 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.514 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.1 98.99 0.11 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.116 -1.593 . . . . 40.0 109.116 -178.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.608 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.9 tpp180 -124.49 138.79 54.31 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.7 -0.882 . . . . 40.0 109.587 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.596 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 22.4 p -106.79 130.64 54.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.5 -0.926 . . . . 40.0 108.5 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.573 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 30.6 m95 -122.43 145.49 48.24 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.379 -0.826 . . . . 40.0 110.545 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.552 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.0 OUTLIER -142.95 145.36 32.93 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.289 -0.882 . . . . 40.0 109.583 -179.236 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -114.8 166.44 11.76 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.09 -1.006 . . . . 40.0 111.557 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 88' ' ' ILE . . . -156.02 143.6 19.42 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.275 -0.891 . . . . 40.0 110.371 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.658 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.3 OUTLIER -66.87 153.38 43.62 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.313 -0.867 . . . . 40.0 111.188 -178.79 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.584 HG21 ' CE2' ' A' ' 7' ' ' PHE . 18.7 mm -136.98 153.5 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.393 -0.817 . . . . 40.0 109.799 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.499 HD22 ' CG ' ' A' ' 86' ' ' ASP . 74.8 m-20 56.44 51.62 11.13 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.064 0.459 . . . . 40.0 111.872 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.475 ' CG ' ' N ' ' A' ' 79' ' ' THR . 59.3 t80 -117.39 154.01 32.06 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.126 -0.983 . . . . 40.0 109.323 178.119 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.65 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.4 p -131.97 -79.61 0.51 Allowed 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.058 0.932 . . . . 40.0 109.424 178.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.65 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -150.89 106.0 3.33 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.773 -0.825 . . . . 40.0 108.773 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 150.76 -107.79 0.36 Allowed Glycine 0 N--CA 1.499 2.883 0 N-CA-C 109.803 -1.319 . . . . 40.0 109.803 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.444 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.7 t80 -125.08 -177.97 4.03 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.345 -1.091 . . . . 40.0 109.376 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.444 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -82.6 -151.74 0.1 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.418 -0.801 . . . . 40.0 110.37 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.452 HD21 ' HB2' ' A' ' 77' ' ' ASN . 36.8 p30 -163.92 -134.21 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.253 -1.017 . . . . 40.0 108.253 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 100' ' ' THR . 53.3 p -116.02 -9.05 11.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.891 -1.131 . . . . 40.0 109.621 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.631 ' OD1' HG22 ' A' ' 100' ' ' THR . 19.7 m-20 -74.45 109.53 8.01 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 120.798 0.333 . . . . 40.0 110.414 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.804 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.45 139.9 44.45 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 119.521 -0.872 . . . . 40.0 109.951 179.31 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.649 ' O ' HD22 ' A' ' 89' ' ' LEU . 18.9 tt -108.79 149.1 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-O 122.403 1.096 . . . . 40.0 110.117 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.649 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.9 mm? -125.74 127.21 45.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.355 -0.841 . . . . 40.0 109.026 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.552 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.0 p90 -129.93 140.65 50.9 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.492 -0.558 . . . . 40.0 109.492 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.573 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.5 p -105.4 -178.07 3.55 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-O 122.27 1.033 . . . . 40.0 112.73 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.596 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -56.2 -50.54 70.95 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-O 122.205 1.003 . . . . 40.0 108.645 178.039 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.539 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -70.25 4.95 1.91 Allowed 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 114.656 -1.157 . . . . 40.0 110.234 -178.85 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.513 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 69.7 m95 72.21 17.4 4.99 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.848 -0.532 . . . . 40.0 111.474 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 95' ' ' LEU . 18.8 mt -72.04 125.83 28.24 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.901 -1.518 . . . . 40.0 106.901 177.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.84 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.4 mp -112.97 133.54 58.48 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 CA-C-O 122.798 1.285 . . . . 40.0 111.975 -177.232 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.577 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 13.3 m-85 -126.14 158.52 35.31 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.402 -1.333 . . . . 40.0 107.402 178.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.4 ' HD2' ' CG2' ' A' ' 109' ' ' ILE . 6.1 ptmm? -126.79 143.75 51.16 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.642 -1.223 . . . . 40.0 112.462 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.421 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.9 129.62 36.63 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.521 -1.289 . . . . 40.0 107.521 177.494 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.631 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.7 p -115.6 9.47 15.34 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 109.718 -0.475 . . . . 40.0 109.718 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.592 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.1 35.18 4.45 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 119.799 -0.76 . . . . 40.0 109.36 179.183 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.2 68.76 0.74 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.383 -0.823 . . . . 40.0 111.168 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 62.07 40.37 12.12 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.47 -0.769 . . . . 40.0 110.657 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.592 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.2 mm-40 -114.39 -76.14 0.58 Allowed 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.749 -1.219 . . . . 40.0 110.002 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.546 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 27.5 p -95.13 124.0 38.93 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.706 -1.246 . . . . 40.0 110.068 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.623 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.7 m-85 -104.44 84.71 2.23 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.475 -0.765 . . . . 40.0 110.891 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.35 145.42 35.26 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.954 -1.091 . . . . 40.0 108.948 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.577 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 59.1 tttp -76.84 143.72 39.54 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.972 -0.455 . . . . 40.0 110.193 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.729 HD11 HG22 ' A' ' 96' ' ' ILE . 36.8 pt -127.45 -31.4 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 109.446 -0.576 . . . . 40.0 109.446 178.266 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.629 HH22 ' CG ' ' A' ' 8' ' ' ASP . 1.4 mmt-85 . . . . . 0 N--CA 1.504 2.241 0 N-CA-C 109.157 -0.683 . . . . 40.0 109.157 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.704 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.1 t . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 121.003 0.43 . . . . 40.0 109.983 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.574 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.0 mt -138.02 148.62 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.288 -0.883 . . . . 40.0 109.824 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -149.24 32.62 0.74 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.265 -0.897 . . . . 40.0 109.515 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 37.9 p -118.65 139.23 51.85 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.782 0.801 . . . . 40.0 110.314 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.507 ' CE2' HG21 ' A' ' 76' ' ' ILE . 55.9 m-85 -40.62 -87.95 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 122.291 1.043 . . . . 40.0 113.367 -178.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.661 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.5 OUTLIER -44.13 -48.78 9.13 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 115.734 -0.666 . . . . 40.0 109.877 -179.042 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.48 -50.49 41.54 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 110.298 -1.121 . . . . 40.0 110.298 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.7 t -65.42 -46.32 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.019 -1.283 . . . . 40.0 109.099 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 1.027 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -55.17 -57.89 9.9 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.573 0.701 . . . . 40.0 110.119 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.21 -49.72 63.34 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.681 -0.637 . . . . 40.0 109.672 178.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.592 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 18.5 t80 -51.65 -50.17 60.87 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.312 1.053 . . . . 40.0 108.605 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.634 HD21 ' HA ' ' A' ' 20' ' ' LEU . 25.6 mt -69.28 -45.12 70.41 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.592 -0.731 . . . . 40.0 111.006 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.402 ' HG3' HD11 ' A' ' 96' ' ' ILE . 16.8 mt-30 -65.08 -21.61 66.84 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 40.0 110.926 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.9 m -103.09 -44.7 5.14 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.015 -1.053 . . . . 40.0 111.56 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.574 ' C ' ' H ' ' A' ' 19' ' ' LYS . 88.9 m-85 -105.53 -13.63 15.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.129 -0.982 . . . . 40.0 111.42 -177.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.573 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 59.77 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 121.303 0.573 . . . . 40.0 111.759 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.592 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.65 117.92 14.93 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 120.494 -1.379 . . . . 40.0 108.886 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.634 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -45.84 128.44 6.89 Favored Pre-proline 0 C--N 1.296 -1.74 0 O-C-N 121.328 -0.858 . . . . 40.0 109.461 -179.571 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.55 ' HD2' HD23 ' A' ' 20' ' ' LEU . 75.1 Cg_exo -34.11 133.31 0.14 Allowed 'Trans proline' 0 N--CA 1.489 1.251 0 C-N-CA 122.976 2.451 . . . . 40.0 112.988 -179.227 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.575 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -64.78 75.75 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.806 0.812 . . . . 40.0 110.791 -178.827 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.704 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 171.83 16.05 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.862 -0.523 . . . . 40.0 110.919 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.498 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 13.4 m-85 -113.06 167.42 10.54 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.432 -0.793 . . . . 40.0 111.353 -179.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -158.16 150.89 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.067 -1.021 . . . . 40.0 108.801 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.3 p -69.7 154.23 42.27 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.384 0.611 . . . . 40.0 109.548 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.643 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -53.29 -50.72 64.3 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.148 -1.427 . . . . 40.0 107.148 176.989 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -47.65 -62.13 1.6 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.51 -0.744 . . . . 40.0 110.544 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -49.05 -57.61 6.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.347 -0.845 . . . . 40.0 109.172 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.9 -49.99 61.92 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.581 -0.699 . . . . 40.0 109.71 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.405 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 51.4 mt-30 -64.05 -50.07 69.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.689 -0.632 . . . . 40.0 110.762 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.89 -32.79 74.28 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.429 -0.794 . . . . 40.0 109.953 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mt -64.89 -20.68 66.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.268 -0.895 . . . . 40.0 109.334 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.548 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.49 -2.02 5.31 Favored Glycine 0 N--CA 1.498 2.767 0 N-CA-C 110.668 -0.973 . . . . 40.0 110.668 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -59.97 114.01 2.6 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.73 -1.453 . . . . 40.0 109.299 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.27 143.44 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 CA-C-O 121.926 0.869 . . . . 40.0 111.168 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.3 78.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.797 -0.564 . . . . 40.0 110.392 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.5 p -79.32 52.08 1.3 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.016 -1.053 . . . . 40.0 108.452 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -175.49 -52.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.095 -0.706 . . . . 40.0 109.095 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.22 18.14 76.43 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.548 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -52.96 130.35 33.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.943 -0.739 . . . . 40.0 109.905 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.637 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 3.7 tp -169.34 -57.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.517 -0.92 . . . . 40.0 108.517 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.68 -25.36 53.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.231 -0.918 . . . . 40.0 109.934 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.87 -60.05 2.53 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.122 -0.695 . . . . 40.0 109.122 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.2 m -74.27 -22.46 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.527 -0.733 . . . . 40.0 109.64 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.613 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.77 78.78 8.88 Favored Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 40.0 109.339 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -56.24 50.55 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 123.311 2.674 . . . . 40.0 113.998 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.547 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.17 0.06 OUTLIER Glycine 0 N--CA 1.504 3.175 0 C-N-CA 119.911 -1.138 . . . . 40.0 111.047 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.613 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 18.6 tttt -120.14 145.59 46.79 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 120.906 -1.349 . . . . 40.0 109.662 179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 14.8 m -116.61 136.3 53.09 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.306 -0.871 . . . . 40.0 109.642 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.508 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.9 mm -69.63 153.79 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.866 . . . . 40.0 110.223 -179.044 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.77 143.98 3.83 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 119.048 -1.548 . . . . 40.0 110.401 179.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 128.88 13.2 2.5 Favored Glycine 0 N--CA 1.496 2.636 0 C-N-CA 119.495 -1.336 . . . . 40.0 111.217 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.617 ' CG ' ' HZ1' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -73.99 -172.83 1.43 Allowed 'General case' 0 C--O 1.195 -1.804 0 O-C-N 120.904 -1.35 . . . . 40.0 110.84 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.48 143.74 40.06 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 CA-C-O 121.701 0.762 . . . . 40.0 110.173 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -155.94 147.2 22.53 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.31 -0.868 . . . . 40.0 109.54 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.717 ' HG ' HH12 ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.19 -16.6 24.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.739 -0.601 . . . . 40.0 110.636 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.9 t30 66.19 28.09 10.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.17 -0.956 . . . . 40.0 111.72 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.717 HH12 ' HG ' ' A' ' 57' ' ' SER . 1.1 mtm-85 -56.45 -31.06 63.62 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.023 -1.048 . . . . 40.0 108.384 178.304 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.488 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 17.4 mp0 -61.93 -12.1 16.46 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.903 -0.777 . . . . 40.0 108.903 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.55 40.44 99.13 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 110.003 -1.239 . . . . 40.0 110.003 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.581 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -93.99 -10.51 33.37 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.828 -0.807 . . . . 40.0 109.23 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.521 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 36.9 mt -135.62 162.64 55.92 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 108.032 -1.099 . . . . 40.0 108.032 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.647 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 97.3 Cg_exo -44.79 139.52 7.54 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 121.536 1.491 . . . . 40.0 112.298 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.497 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.94 -169.58 12.49 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 110.361 -1.096 . . . . 40.0 110.361 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.472 ' HB3' ' NH2' ' A' ' 69' ' ' ARG . 3.4 pttm 175.35 -156.66 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.924 -1.51 . . . . 40.0 106.924 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.428 ' O ' ' OG ' ' A' ' 67' ' ' SER . 59.5 p -74.41 84.54 1.97 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.546 -1.279 . . . . 40.0 107.546 178.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.42 102.82 0.2 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 108.417 -1.873 . . . . 40.0 108.417 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.566 HH11 ' CG ' ' A' ' 93' ' ' ASP . 15.6 tpp180 -125.51 141.55 51.98 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.869 -0.783 . . . . 40.0 109.55 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.624 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 25.5 p -108.88 131.31 55.13 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.741 -0.837 . . . . 40.0 108.741 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.647 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.2 m95 -121.91 147.97 45.34 Favored 'General case' 0 N--CA 1.5 2.047 0 C-N-CA 119.453 -0.899 . . . . 40.0 111.014 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.589 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.3 mpp_? -146.02 144.72 30.26 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.183 -0.948 . . . . 40.0 109.676 -178.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.643 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.09 165.55 13.01 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.146 -0.971 . . . . 40.0 111.515 179.558 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.498 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -152.16 147.5 26.5 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.504 -0.748 . . . . 40.0 109.574 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.685 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -71.38 150.77 44.71 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.592 -0.693 . . . . 40.0 110.244 -179.061 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.507 HG21 ' CE2' ' A' ' 7' ' ' PHE . 15.5 mm -134.66 150.59 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 40.0 109.916 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.528 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.7 m-20 58.26 60.15 2.76 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-O 121.235 0.541 . . . . 40.0 111.485 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.637 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 66.2 t80 -123.87 154.28 39.89 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.103 -0.998 . . . . 40.0 109.385 178.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.602 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.0 p -132.19 -80.38 0.5 Allowed 'General case' 0 N--CA 1.502 2.154 0 CA-C-O 121.719 0.771 . . . . 40.0 110.005 179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.602 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.16 102.01 2.75 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 109.167 -0.679 . . . . 40.0 109.167 -179.107 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.88 -104.32 0.26 Allowed Glycine 0 N--CA 1.5 2.965 0 N-CA-C 109.833 -1.307 . . . . 40.0 109.833 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.451 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.8 t80 -125.79 -178.42 4.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.47 -1.018 . . . . 40.0 109.934 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.456 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.7 mtm180 -83.86 -151.88 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.655 -0.653 . . . . 40.0 110.425 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.511 HD21 ' HB2' ' A' ' 86' ' ' ASP . 47.7 p-10 -164.7 -136.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.851 -0.796 . . . . 40.0 108.851 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.459 ' OG ' ' O ' ' A' ' 100' ' ' THR . 22.4 p -113.13 -11.85 13.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.993 -1.067 . . . . 40.0 109.871 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.572 ' OD1' HG22 ' A' ' 100' ' ' THR . 11.8 m-20 -71.79 109.17 5.49 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 120.964 0.412 . . . . 40.0 110.518 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.831 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.85 140.55 44.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.533 -0.729 . . . . 40.0 110.025 179.657 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.695 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.9 tt -111.23 149.93 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 CA-C-O 122.375 1.084 . . . . 40.0 109.757 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.695 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -127.18 127.54 44.67 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 109.326 -0.62 . . . . 40.0 109.326 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.589 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.6 p90 -131.65 141.76 49.69 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 109.116 -0.698 . . . . 40.0 109.116 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.536 ' HB3' ' CE2' ' A' ' 71' ' ' TRP . 64.3 p -107.61 -179.86 4.03 Favored 'General case' 0 N--CA 1.505 2.287 0 CA-C-O 122.22 1.01 . . . . 40.0 112.418 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.624 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.77 -50.54 63.34 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 122.35 1.072 . . . . 40.0 108.636 178.508 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.566 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 3.83 1.84 Allowed 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.598 -1.183 . . . . 40.0 110.241 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.535 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 78.5 m95 72.53 13.59 5.36 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.764 -0.585 . . . . 40.0 111.758 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.494 ' HA ' HD23 ' A' ' 95' ' ' LEU . 21.1 mt -70.01 128.9 37.94 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.819 -1.8 . . . . 40.0 107.562 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 1.027 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mt -114.59 135.54 54.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 CA-C-O 122.707 1.241 . . . . 40.0 112.527 -176.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.559 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.8 m-85 -127.75 156.49 42.35 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.377 -1.342 . . . . 40.0 107.377 179.057 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.464 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 4.7 ptmm? -125.31 143.64 50.87 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 118.758 -1.177 . . . . 40.0 112.73 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.408 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -134.84 132.09 38.19 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.233 -1.395 . . . . 40.0 107.233 177.722 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.572 HG22 ' OD1' ' A' ' 86' ' ' ASP . 4.0 p -117.9 11.56 13.51 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 109.566 -0.531 . . . . 40.0 109.566 -177.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.604 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -116.32 32.97 5.8 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.902 -0.719 . . . . 40.0 109.798 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 64.37 66.62 0.61 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.012 -1.055 . . . . 40.0 111.03 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 60.76 43.2 12.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.266 -0.896 . . . . 40.0 110.472 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.604 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.6 mm-40 -116.37 -76.81 0.57 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.621 -1.299 . . . . 40.0 109.104 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.544 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.9 p -94.25 122.27 36.61 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.67 -1.269 . . . . 40.0 109.785 -178.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.55 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 4.9 m-85 -104.11 84.73 2.27 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.54 -0.725 . . . . 40.0 110.972 -179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 m -77.9 144.51 36.84 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.916 -1.115 . . . . 40.0 109.314 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.572 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 60.5 tttp -75.83 147.72 38.93 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.41 -0.806 . . . . 40.0 110.592 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.81 HD11 HG22 ' A' ' 96' ' ' ILE . 38.8 pt -129.81 -31.14 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 109.223 -0.658 . . . . 40.0 109.223 178.147 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.661 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.15 0 CA-C-O 118.514 -0.755 . . . . 40.0 109.097 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.678 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 109.917 -0.401 . . . . 40.0 109.917 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.582 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.7 mt -140.13 147.79 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 40.0 109.068 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -149.98 35.03 0.67 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.072 -1.017 . . . . 40.0 109.454 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.6 p -119.76 144.07 47.47 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 119.577 -0.849 . . . . 40.0 110.512 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.507 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 62.0 m-85 -45.23 -85.56 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 N-CA-C 113.471 0.915 . . . . 40.0 113.471 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.642 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.14 -46.26 17.08 Favored 'General case' 0 C--N 1.288 -2.071 0 O-C-N 121.623 -0.673 . . . . 40.0 110.117 -179.294 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.03 60.45 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.732 -0.947 . . . . 40.0 110.732 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.6 t -66.84 -42.11 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.019 -1.283 . . . . 40.0 108.29 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.909 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -60.51 -55.4 33.88 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.961 -1.087 . . . . 40.0 109.585 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.23 -50.24 62.37 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.478 -0.764 . . . . 40.0 109.186 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.607 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 19.2 t80 -52.78 -49.54 65.37 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.72 0.772 . . . . 40.0 109.81 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.647 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.6 mt -68.6 -45.8 71.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.596 -0.69 . . . . 40.0 109.855 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -64.05 -23.02 67.17 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.6 -1.24 . . . . 40.0 110.625 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.2 m -105.41 -41.76 5.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.66 -1.275 . . . . 40.0 111.66 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.601 ' O ' ' N ' ' A' ' 19' ' ' LYS . 79.2 m-85 -103.46 -16.08 15.69 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.762 -1.211 . . . . 40.0 110.846 -177.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.647 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.45 -36.64 0.11 Allowed 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 121.546 0.688 . . . . 40.0 110.662 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.607 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -66.86 118.72 10.75 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 120.83 -1.168 . . . . 40.0 108.265 179.06 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.503 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -45.51 132.93 6.19 Favored Pre-proline 0 N--CA 1.499 2.02 0 O-C-N 121.366 -0.834 . . . . 40.0 108.923 -179.222 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.479 ' O ' ' N ' ' A' ' 23' ' ' ASN . 62.6 Cg_exo -35.31 134.14 0.2 Allowed 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 122.246 1.964 . . . . 40.0 112.557 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.75 73.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.695 0.759 . . . . 40.0 110.067 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.678 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.0 p-10 174.05 19.23 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.763 -0.585 . . . . 40.0 111.197 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.515 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 13.4 m-85 -118.04 162.04 18.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.489 0.662 . . . . 40.0 111.542 -178.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -150.64 152.43 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.275 -0.891 . . . . 40.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 53' ' ' GLY . 76.2 p -72.4 151.7 42.46 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.532 -0.73 . . . . 40.0 109.407 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.646 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -48.7 -53.66 17.94 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.121 -1.066 . . . . 40.0 108.121 177.517 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.5 t -46.19 -63.42 0.99 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.547 -0.721 . . . . 40.0 110.312 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -48.27 -58.4 4.61 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.202 -0.937 . . . . 40.0 108.962 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.72 -49.41 62.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.353 -0.842 . . . . 40.0 110.228 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.441 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 55.6 mt-30 -64.99 -48.97 72.07 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.44 -0.787 . . . . 40.0 110.255 -178.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.28 -31.85 72.9 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.576 -0.703 . . . . 40.0 110.985 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mt -67.68 -19.3 65.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.498 -0.751 . . . . 40.0 109.075 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.5 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.14 0.4 5.1 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 119.945 -1.121 . . . . 40.0 111.358 178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -62.61 114.08 3.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.595 -1.532 . . . . 40.0 108.603 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.3 t -122.11 140.92 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.548 0 CA-C-O 121.891 0.853 . . . . 40.0 110.377 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.51 -47.02 85.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.44 -0.787 . . . . 40.0 109.886 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.6 p -77.74 50.42 0.84 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.886 -1.134 . . . . 40.0 109.063 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -175.79 -48.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.137 0.494 . . . . 40.0 109.767 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.5 72.76 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 108.912 -1.675 . . . . 40.0 108.912 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.5 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.3 p-10 -56.04 130.76 45.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.798 -0.825 . . . . 40.0 109.326 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.602 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.0 tp -170.1 -58.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.66 -0.867 . . . . 40.0 108.66 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.54 -25.48 52.09 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.388 -0.82 . . . . 40.0 109.673 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.435 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -75.63 -65.22 0.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.0 -0.741 . . . . 40.0 109.0 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.2 m -67.14 -29.83 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.428 -0.795 . . . . 40.0 109.753 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -140.46 77.71 23.19 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.746 -0.596 . . . . 40.0 110.227 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.83 50.02 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 123.276 2.65 . . . . 40.0 113.829 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.18 43.83 0.04 OUTLIER Glycine 0 N--CA 1.497 2.733 0 C-N-CA 119.556 -1.307 . . . . 40.0 111.375 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.556 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 10.2 tttt -121.75 145.04 48.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.874 -1.368 . . . . 40.0 109.436 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 m -119.26 133.74 55.59 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.797 -1.189 . . . . 40.0 110.455 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.8 mm -65.49 153.48 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.19 -0.944 . . . . 40.0 110.216 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.502 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.37 145.63 4.17 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.525 -1.43 . . . . 40.0 109.525 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.427 ' O ' HG22 ' A' ' 26' ' ' THR . . . 125.42 15.4 3.03 Favored Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.877 -1.154 . . . . 40.0 111.181 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.533 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -74.81 -166.86 0.5 Allowed 'General case' 0 C--O 1.194 -1.863 0 O-C-N 120.576 -1.544 . . . . 40.0 110.332 -179.077 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.5 mm -134.54 139.57 47.52 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.706 0 CA-C-O 121.6 0.714 . . . . 40.0 109.581 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -151.62 146.99 26.22 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.894 -0.78 . . . . 40.0 108.894 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.683 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -94.16 -18.06 22.12 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 40.0 109.672 -179.186 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.496 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.6 t30 68.71 30.24 4.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.359 -0.838 . . . . 40.0 111.917 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.683 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 0.9 OUTLIER -57.92 -29.98 65.55 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.904 -1.122 . . . . 40.0 108.134 178.534 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.9 mp0 -64.35 -11.38 31.83 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.324 0.583 . . . . 40.0 109.462 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.2 44.5 98.04 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 110.339 -1.104 . . . . 40.0 110.339 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.599 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.48 -12.74 25.36 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.566 -0.961 . . . . 40.0 108.828 179.849 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.671 HD21 ' CD2' ' A' ' 106' ' ' PHE . 52.3 mt -136.8 162.17 57.49 Favored Pre-proline 0 N--CA 1.497 1.912 0 N-CA-C 108.318 -0.993 . . . . 40.0 108.318 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.492 ' O ' ' NE1' ' A' ' 71' ' ' TRP . 86.6 Cg_exo -43.75 142.36 3.47 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 122.103 1.869 . . . . 40.0 112.667 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.624 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.77 -165.94 11.35 Favored Glycine 0 N--CA 1.492 2.429 0 C-N-CA 120.018 -1.087 . . . . 40.0 110.915 -178.311 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.471 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.3 pttm 173.5 -157.79 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 107.775 -1.194 . . . . 40.0 107.775 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.481 ' O ' ' OG ' ' A' ' 67' ' ' SER . 51.6 p -73.54 86.23 1.57 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 106.983 -1.488 . . . . 40.0 106.983 177.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.471 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.91 99.59 0.23 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.295 -1.522 . . . . 40.0 109.295 -178.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.624 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 18.5 tpp180 -121.85 140.84 51.89 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.388 -1.066 . . . . 40.0 110.031 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.6 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 24.8 p -109.4 130.83 55.48 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 108.123 -1.066 . . . . 40.0 108.123 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.503 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 33.8 m95 -121.82 143.69 49.26 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.324 -0.86 . . . . 40.0 111.16 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.579 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.1 mpp_? -141.61 147.5 37.73 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.453 -0.779 . . . . 40.0 109.692 -178.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.646 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -119.24 169.82 9.64 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 119.551 -0.86 . . . . 40.0 112.058 179.897 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.515 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -157.34 145.27 19.05 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.521 -0.737 . . . . 40.0 110.272 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.642 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -69.36 151.93 45.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.667 -0.645 . . . . 40.0 110.292 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.507 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 14.5 mm -135.95 152.65 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.178 -0.951 . . . . 40.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.532 HD22 ' CG ' ' A' ' 86' ' ' ASP . 75.1 m-20 57.94 51.15 9.3 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.01 0.433 . . . . 40.0 111.507 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.602 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 57.1 t80 -116.85 153.13 33.05 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.972 -1.08 . . . . 40.0 109.217 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.604 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.7 p -132.8 -77.55 0.49 Allowed 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.854 0.835 . . . . 40.0 109.608 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.604 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.58 102.28 2.71 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 109.442 -0.577 . . . . 40.0 109.442 -179.392 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 153.09 -104.27 0.25 Allowed Glycine 0 N--CA 1.499 2.874 0 N-CA-C 109.841 -1.304 . . . . 40.0 109.841 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 11.8 t80 -126.03 -179.41 4.69 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.681 -0.894 . . . . 40.0 109.91 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.46 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.3 mtm180 -80.96 -150.87 0.08 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 121.581 0.705 . . . . 40.0 110.049 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.461 HD21 ' HB2' ' A' ' 77' ' ' ASN . 27.3 p30 -164.3 -136.62 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.182 -1.044 . . . . 40.0 108.182 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.467 ' OG ' ' O ' ' A' ' 100' ' ' THR . 50.6 p -114.04 -9.12 13.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.808 -1.183 . . . . 40.0 109.192 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.665 ' OD1' HG22 ' A' ' 100' ' ' THR . 18.3 m-20 -73.69 109.36 7.14 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.287 -0.415 . . . . 40.0 110.394 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.83 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.12 137.25 40.81 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.369 -0.832 . . . . 40.0 110.258 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.544 ' O ' HD22 ' A' ' 89' ' ' LEU . 15.2 tt -108.39 145.88 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 122.61 1.195 . . . . 40.0 110.592 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.0 mm? -123.1 127.23 48.44 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.841 -0.8 . . . . 40.0 108.841 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.579 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.0 p90 -132.05 140.72 48.98 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.746 -0.835 . . . . 40.0 108.746 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.503 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.6 p -107.23 178.46 4.54 Favored 'General case' 0 N--CA 1.51 2.56 0 CA-C-O 122.511 1.148 . . . . 40.0 112.662 -176.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.6 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -49.77 -54.97 15.84 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.569 1.176 . . . . 40.0 108.353 177.164 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.624 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -67.75 6.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.51 -1.223 . . . . 40.0 111.098 -178.848 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.452 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 67.4 m95 70.76 15.22 6.97 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.807 -0.558 . . . . 40.0 112.172 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.9 mt -70.37 127.14 31.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.169 -1.582 . . . . 40.0 106.819 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.909 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.3 mp -113.92 135.21 54.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-O 123.004 1.383 . . . . 40.0 112.224 -177.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.628 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.0 m-85 -128.43 158.17 39.06 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.577 -1.268 . . . . 40.0 107.577 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.448 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.9 ptmm? -126.69 145.97 50.38 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.714 -1.195 . . . . 40.0 112.566 -178.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.423 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.93 130.58 33.94 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.282 -1.377 . . . . 40.0 107.282 177.31 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.665 HG22 ' OD1' ' A' ' 86' ' ' ASP . 2.4 p -116.13 11.07 15.14 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.234 -0.654 . . . . 40.0 109.234 -177.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.589 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -117.29 34.71 4.99 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.723 -0.791 . . . . 40.0 109.498 178.891 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.8 68.33 0.7 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.431 -0.793 . . . . 40.0 111.02 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 60.1 43.85 13.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.429 -0.795 . . . . 40.0 110.279 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.589 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 28.7 mm-40 -116.47 -77.89 0.57 Allowed 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.833 -1.167 . . . . 40.0 108.66 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.514 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.4 p -94.25 120.21 34.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.737 -1.227 . . . . 40.0 110.642 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.671 ' CD2' HD21 ' A' ' 63' ' ' LEU . 10.0 m-85 -101.01 82.73 2.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.342 -0.848 . . . . 40.0 111.589 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.2 m -75.54 142.1 42.86 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.038 -1.038 . . . . 40.0 109.372 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.628 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 61.4 tttp -76.45 148.87 36.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.539 -0.726 . . . . 40.0 110.452 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.678 HD11 HG22 ' A' ' 96' ' ' ILE . 32.7 pt -131.4 -30.13 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 109.144 -0.687 . . . . 40.0 109.144 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.642 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.903 0 CA-C-O 118.394 -0.812 . . . . 40.0 109.088 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.684 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.5 t . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.176 -0.676 . . . . 40.0 109.176 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.563 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.05 150.34 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.468 -0.77 . . . . 40.0 108.992 -179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -150.06 35.15 0.66 Allowed 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.159 -0.963 . . . . 40.0 109.397 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.4 p -119.27 141.58 48.83 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.924 -0.71 . . . . 40.0 110.331 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.489 ' CE2' HG21 ' A' ' 76' ' ' ILE . 69.7 m-85 -43.54 -84.39 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.024 0.916 . . . . 40.0 112.904 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.6 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.97 -47.09 21.92 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 121.724 -0.61 . . . . 40.0 110.08 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.05 -48.53 62.66 Favored Glycine 0 N--CA 1.502 3.046 0 N-CA-C 110.497 -1.041 . . . . 40.0 110.497 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -44.11 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.4 . . . . 40.0 108.452 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.724 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -57.81 -58.04 10.11 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.607 -0.683 . . . . 40.0 110.12 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -51.11 61.35 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.693 -0.855 . . . . 40.0 108.693 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.616 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.9 t80 -50.35 -50.21 51.78 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.931 0.872 . . . . 40.0 109.671 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.614 HD21 ' HA ' ' A' ' 20' ' ' LEU . 24.4 mt -69.69 -45.17 68.9 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.543 -0.723 . . . . 40.0 110.481 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -63.53 -20.89 66.0 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 119.411 -0.915 . . . . 40.0 111.417 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.1 m -105.73 -45.02 4.51 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.692 -1.255 . . . . 40.0 111.463 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.573 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.6 m-85 -102.9 -15.07 16.29 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.351 -0.843 . . . . 40.0 110.913 -177.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.561 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-70 60.6 -30.5 0.06 Allowed 'General case' 0 N--CA 1.505 2.322 0 CA-C-O 121.447 0.641 . . . . 40.0 111.045 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.616 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -69.72 117.99 12.02 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.695 -1.253 . . . . 40.0 108.792 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.614 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -46.5 132.17 7.98 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.47 -0.769 . . . . 40.0 109.427 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.476 ' HD2' HD23 ' A' ' 20' ' ' LEU . 67.7 Cg_exo -36.59 133.66 0.35 Allowed 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.866 2.377 . . . . 40.0 112.5 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.566 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -64.67 75.62 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.011 0.91 . . . . 40.0 110.433 -179.174 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.684 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 174.0 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.733 -0.605 . . . . 40.0 110.406 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 50' ' ' SER . 18.1 m-85 -114.52 163.96 14.65 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.426 -0.796 . . . . 40.0 111.396 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.98 152.06 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.45 -0.781 . . . . 40.0 109.417 178.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 53' ' ' GLY . 61.2 p -72.39 150.75 43.13 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 108.909 -0.774 . . . . 40.0 108.909 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.632 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -49.98 -52.19 35.67 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.529 -0.915 . . . . 40.0 108.529 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -46.74 -61.58 1.78 Allowed 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.446 -0.784 . . . . 40.0 110.268 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.413 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 41.8 mt-10 -50.76 -56.64 11.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.153 -0.967 . . . . 40.0 109.234 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.97 -49.02 66.96 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.459 -0.776 . . . . 40.0 109.739 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.4 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 50.2 mt-30 -65.65 -49.22 69.43 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.751 -0.593 . . . . 40.0 110.291 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.68 -31.04 70.74 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.399 -0.813 . . . . 40.0 110.351 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.38 -18.85 65.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.134 -0.979 . . . . 40.0 109.267 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.562 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 133.04 -4.2 4.95 Favored Glycine 0 N--CA 1.497 2.719 0 C-N-CA 119.871 -1.157 . . . . 40.0 111.087 178.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -62.02 116.04 4.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.544 -1.562 . . . . 40.0 108.746 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 31.0 t -124.12 142.6 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 121.87 0.843 . . . . 40.0 110.506 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.06 83.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.353 -0.842 . . . . 40.0 110.561 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 p -77.68 48.17 0.66 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.825 -1.172 . . . . 40.0 109.318 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -173.58 -50.3 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.572 -0.705 . . . . 40.0 109.328 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.18 24.59 76.5 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 108.974 -1.651 . . . . 40.0 108.974 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.562 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -58.77 130.83 48.8 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.748 -0.854 . . . . 40.0 109.42 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.526 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.2 tp -170.77 -56.69 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.295 -1.002 . . . . 40.0 108.295 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.09 -23.27 32.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 40.0 109.906 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.79 -66.28 0.88 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.899 -0.778 . . . . 40.0 108.899 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 24.5 m -67.32 -26.98 37.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 109.079 -0.712 . . . . 40.0 109.079 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.661 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -142.5 77.97 16.77 Favored Pre-proline 0 N--CA 1.488 1.443 0 O-C-N 121.411 -0.806 . . . . 40.0 109.982 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.95 50.01 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.972 2.448 . . . . 40.0 113.966 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.44 42.22 0.05 OUTLIER Glycine 0 N--CA 1.5 2.942 0 C-N-CA 119.766 -1.207 . . . . 40.0 111.338 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.661 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 13.4 tttt -119.83 147.69 44.36 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.906 -1.349 . . . . 40.0 110.035 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.458 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 13.1 m -117.6 134.1 55.24 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.155 -0.965 . . . . 40.0 109.994 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.482 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.3 mm -67.47 154.89 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.921 -1.112 . . . . 40.0 110.589 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.444 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.63 150.62 5.29 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.491 -1.338 . . . . 40.0 110.049 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.434 ' O ' HG22 ' A' ' 26' ' ' THR . . . 122.34 17.04 3.7 Favored Glycine 0 N--CA 1.494 2.561 0 O-C-N 121.213 -1.169 . . . . 40.0 110.739 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.549 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -75.64 -167.65 0.72 Allowed 'General case' 0 C--O 1.198 -1.628 0 O-C-N 120.989 -1.301 . . . . 40.0 110.426 -179.345 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.8 mm -134.46 141.56 43.13 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.542 0 CA-C-O 121.506 0.669 . . . . 40.0 110.239 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -153.46 145.91 24.06 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.173 -0.954 . . . . 40.0 110.033 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.68 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -92.24 -17.54 24.67 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.444 -0.785 . . . . 40.0 110.14 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.493 HD21 ' H ' ' A' ' 63' ' ' LEU . 66.5 t30 67.21 32.9 5.79 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.06 -1.025 . . . . 40.0 111.419 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.68 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 0.8 OUTLIER -60.84 -29.32 69.43 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.981 -1.074 . . . . 40.0 108.439 178.529 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.437 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 23.8 mp0 -64.63 -13.91 55.72 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.526 -0.546 . . . . 40.0 109.526 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.25 42.69 94.05 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 109.683 -1.367 . . . . 40.0 109.683 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.619 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.57 -10.27 30.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.647 -0.914 . . . . 40.0 109.197 -179.592 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.554 HD21 ' CD2' ' A' ' 106' ' ' PHE . 30.7 mt -138.94 164.05 42.12 Favored Pre-proline 0 N--CA 1.492 1.659 0 N-CA-C 108.535 -0.913 . . . . 40.0 108.535 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.602 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 87.0 Cg_exo -45.16 139.91 8.16 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.025 1.817 . . . . 40.0 111.659 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.643 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.04 -166.29 11.69 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 110.392 -1.083 . . . . 40.0 110.392 -178.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.555 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 pttm 173.33 -158.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 107.859 -1.163 . . . . 40.0 107.859 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' A' ' 67' ' ' SER . 24.2 p -73.64 85.42 1.6 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.165 -1.42 . . . . 40.0 107.165 177.364 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.555 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 79.72 99.94 0.28 Allowed Glycine 0 N--CA 1.496 2.679 0 N-CA-C 108.863 -1.695 . . . . 40.0 108.863 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.643 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 16.9 tpp180 -123.45 140.89 52.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.535 -0.979 . . . . 40.0 110.508 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.612 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 29.5 p -108.83 130.25 55.4 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.632 -0.877 . . . . 40.0 108.632 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.602 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 30.7 m95 -121.48 146.85 46.49 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.343 -0.848 . . . . 40.0 110.381 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.649 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.9 OUTLIER -145.89 146.88 31.26 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.538 -0.726 . . . . 40.0 109.624 -179.21 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.632 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.3 170.72 8.32 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.177 -1.009 . . . . 40.0 112.352 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.445 ' O ' HG22 ' A' ' 88' ' ' ILE . . . -157.36 145.41 19.13 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.487 -0.758 . . . . 40.0 109.981 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.669 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -70.44 153.25 43.16 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.551 -0.718 . . . . 40.0 110.408 -179.206 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.489 HG21 ' CE2' ' A' ' 7' ' ' PHE . 17.8 mm -137.61 153.37 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 40.0 110.088 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.489 HD22 ' CG ' ' A' ' 86' ' ' ASP . 73.8 m-20 55.07 58.49 4.69 Favored 'General case' 0 N--CA 1.5 2.033 0 CA-C-O 121.186 0.517 . . . . 40.0 111.267 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.526 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 56.1 t80 -121.83 155.2 35.87 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 40.0 108.739 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.576 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.8 p -132.32 -79.91 0.5 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 121.672 0.749 . . . . 40.0 109.84 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.576 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.27 101.67 2.86 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.88 -0.785 . . . . 40.0 108.88 -179.284 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.14 -109.09 0.4 Allowed Glycine 0 N--CA 1.5 2.952 0 C-N-CA 119.753 -1.213 . . . . 40.0 110.108 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.445 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.5 t80 -119.42 -177.97 3.49 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.358 -1.084 . . . . 40.0 110.06 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.445 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 4.2 mtm180 -84.47 -150.33 0.12 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.463 -0.773 . . . . 40.0 110.561 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.406 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.7 p30 -164.98 -135.93 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.743 -0.836 . . . . 40.0 108.743 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 100' ' ' THR . 45.6 p -114.21 -10.25 12.77 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.835 -1.166 . . . . 40.0 109.417 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.606 ' OD1' HG22 ' A' ' 100' ' ' THR . 15.5 m-20 -73.04 106.43 4.91 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.95 0.405 . . . . 40.0 110.131 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.858 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -134.05 139.27 45.88 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 119.585 -0.846 . . . . 40.0 110.172 179.768 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.639 ' O ' HD22 ' A' ' 89' ' ' LEU . 18.1 tt -110.12 148.78 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-O 122.064 0.935 . . . . 40.0 110.56 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.639 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.0 mm? -125.21 128.5 48.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.582 -0.699 . . . . 40.0 109.393 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.649 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.4 p90 -131.07 141.71 50.21 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 109.043 -0.725 . . . . 40.0 109.043 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.549 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 60.0 p -107.28 -179.11 3.83 Favored 'General case' 0 N--CA 1.504 2.252 0 CA-C-O 122.162 0.982 . . . . 40.0 112.209 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.612 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -54.55 -53.6 52.33 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.324 1.059 . . . . 40.0 108.794 177.735 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.58 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -65.9 2.2 1.14 Allowed 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 114.643 -1.162 . . . . 40.0 109.975 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 78.5 m95 73.56 16.85 3.88 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 122.017 -0.427 . . . . 40.0 111.652 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 95' ' ' LEU . 24.4 mt -70.52 126.56 29.97 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 106.79 -1.559 . . . . 40.0 106.79 177.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.821 HG22 HD11 ' A' ' 109' ' ' ILE . 2.7 mp -114.26 134.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 122.706 1.241 . . . . 40.0 112.013 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.524 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 10.3 m-85 -127.68 158.88 36.4 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.95 -1.13 . . . . 40.0 107.95 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.435 ' HB3' HD13 ' A' ' 109' ' ' ILE . 5.4 ptmm? -127.13 145.79 50.62 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 118.634 -1.226 . . . . 40.0 112.291 -178.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.454 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.97 129.81 32.69 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 106.897 -1.52 . . . . 40.0 106.897 177.433 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.606 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.4 p -115.98 9.93 15.0 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 109.585 -0.524 . . . . 40.0 109.585 -177.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.594 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.2 34.21 5.0 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.821 -0.751 . . . . 40.0 109.818 178.947 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 62.46 67.47 0.72 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.16 -0.963 . . . . 40.0 111.077 178.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 61.15 43.21 11.34 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -0.825 . . . . 40.0 110.451 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.594 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.5 mm-40 -115.88 -77.92 0.57 Allowed 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.614 -1.304 . . . . 40.0 109.267 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.503 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.2 p -93.74 120.82 34.51 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.068 -1.02 . . . . 40.0 110.207 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.556 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 6.1 m-85 -102.73 83.77 2.31 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.378 0.609 . . . . 40.0 110.685 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.28 144.88 35.75 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.213 -0.995 . . . . 40.0 108.903 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.543 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 57.8 tttp -76.67 146.99 37.75 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.214 0.53 . . . . 40.0 110.322 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.821 HD11 HG22 ' A' ' 96' ' ' ILE . 15.6 pt -130.22 -28.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 109.148 -0.686 . . . . 40.0 109.148 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.603 HH11 ' HG2' ' A' ' 110' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 N-CA-C 109.128 -0.693 . . . . 40.0 109.128 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.68 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.8 t . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 109.249 -0.649 . . . . 40.0 109.249 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.587 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 10.6 mt -139.24 147.7 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.453 -0.78 . . . . 40.0 109.415 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -149.55 34.4 0.7 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.276 -0.89 . . . . 40.0 109.712 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.3 p -119.51 144.75 46.85 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.913 -0.715 . . . . 40.0 110.115 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.518 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 62.5 m-85 -45.6 -86.83 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.49 -0.757 . . . . 40.0 112.752 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.633 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -46.18 -48.05 17.61 Favored 'General case' 0 C--N 1.289 -2.061 0 O-C-N 121.672 -0.643 . . . . 40.0 109.761 -178.865 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.14 -53.35 23.62 Favored Glycine 0 N--CA 1.502 3.071 0 N-CA-C 110.149 -1.18 . . . . 40.0 110.149 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.83 -44.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 O-C-N 120.867 -1.372 . . . . 40.0 109.733 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 1.02 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.76 -57.06 14.09 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.257 -0.902 . . . . 40.0 109.934 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.99 -47.05 65.07 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 178.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.438 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.7 t80 -54.63 -50.26 68.54 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.901 0.858 . . . . 40.0 109.057 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.686 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 72.2 mt -70.72 -44.7 66.31 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.727 -0.608 . . . . 40.0 110.618 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.565 ' HG3' HD11 ' A' ' 96' ' ' ILE . 4.9 mt-30 -61.73 -26.86 68.32 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 119.122 -1.031 . . . . 40.0 110.722 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.9 m -102.28 -44.22 5.47 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.872 -1.143 . . . . 40.0 111.926 -178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.591 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.5 m-85 -102.85 -16.2 15.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.906 -1.121 . . . . 40.0 110.425 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.686 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 62.1 -27.58 0.06 Allowed 'General case' 0 N--CA 1.502 2.169 0 CA-C-O 121.36 0.6 . . . . 40.0 110.895 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -71.28 122.41 20.21 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 120.82 -1.175 . . . . 40.0 108.756 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.682 ' HA ' HD21 ' A' ' 14' ' ' LEU . 2.0 mt -47.29 132.36 9.76 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.428 -0.795 . . . . 40.0 109.144 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.52 ' HD2' HD23 ' A' ' 20' ' ' LEU . 71.5 Cg_exo -40.0 131.71 2.07 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 122.199 1.932 . . . . 40.0 112.626 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.625 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.47 78.59 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.876 0.845 . . . . 40.0 110.335 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.68 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 170.47 15.17 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.915 -0.491 . . . . 40.0 110.503 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.435 ' HA ' ' O ' ' A' ' 50' ' ' SER . 17.5 m-85 -114.18 167.13 10.95 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.497 -0.752 . . . . 40.0 111.233 -179.128 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.55 152.1 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 40.0 109.049 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.448 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 77.8 p -72.17 151.67 42.8 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 108.405 -0.961 . . . . 40.0 108.405 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.649 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -50.83 -51.9 46.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.759 -1.213 . . . . 40.0 108.38 177.883 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.7 t -46.32 -62.91 1.14 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.841 -0.537 . . . . 40.0 110.252 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.479 ' O ' HD12 ' A' ' 33' ' ' LEU . 45.2 mt-10 -48.74 -58.02 5.42 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.019 -0.734 . . . . 40.0 109.019 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.18 -49.33 64.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.591 -0.693 . . . . 40.0 109.575 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -64.86 -48.21 75.11 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.369 -0.832 . . . . 40.0 111.034 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -31.8 72.1 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 40.0 110.746 -179.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 29' ' ' GLU . 0.5 OUTLIER -66.92 -20.51 65.92 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.77 -0.826 . . . . 40.0 108.77 179.749 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.562 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 132.61 -3.66 5.05 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 120.127 -1.035 . . . . 40.0 111.031 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -60.94 114.32 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.549 -1.56 . . . . 40.0 108.318 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.8 142.85 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.376 -0.828 . . . . 40.0 110.48 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.46 -48.97 79.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.495 -0.753 . . . . 40.0 110.648 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 p -78.09 46.88 0.62 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.112 -0.992 . . . . 40.0 109.147 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -169.92 -50.37 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 108.824 -0.806 . . . . 40.0 108.824 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.92 20.23 75.96 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.1 -1.6 . . . . 40.0 109.1 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.562 HD21 ' C ' ' A' ' 34' ' ' GLY . 6.7 p-10 -55.19 127.23 28.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.68 -0.894 . . . . 40.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.576 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.4 tp -166.83 -55.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 108.533 -0.914 . . . . 40.0 108.533 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -29.74 53.41 Favored 'General case' 0 C--N 1.288 -2.069 0 O-C-N 121.052 -1.03 . . . . 40.0 110.065 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -62.73 1.34 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.396 -0.815 . . . . 40.0 109.443 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 24.4 m -71.57 -23.18 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-N 116.23 -0.441 . . . . 40.0 109.988 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.648 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.11 76.2 10.44 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 120.981 -1.075 . . . . 40.0 108.937 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -58.73 53.27 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.504 0 C-N-CA 122.391 2.06 . . . . 40.0 113.274 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.69 38.05 0.06 OUTLIER Glycine 0 N--CA 1.5 2.951 0 C-N-CA 119.913 -1.137 . . . . 40.0 111.577 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.648 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 19.9 tttt -119.72 148.34 43.51 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.795 -1.415 . . . . 40.0 110.092 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 5.2 m -120.26 134.8 55.19 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.136 -0.978 . . . . 40.0 109.93 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.461 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.9 mm -67.05 155.35 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -0.966 . . . . 40.0 110.815 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.527 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.43 148.08 4.67 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 119.615 -1.279 . . . . 40.0 110.257 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 123.53 15.99 3.53 Favored Glycine 0 N--CA 1.496 2.642 0 C-N-CA 119.865 -1.159 . . . . 40.0 110.997 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.649 ' CG ' ' HZ2' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -74.31 -168.87 0.71 Allowed 'General case' 0 C--O 1.192 -1.936 0 O-C-N 121.04 -1.27 . . . . 40.0 110.386 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -132.85 140.92 46.26 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 CA-C-O 121.728 0.775 . . . . 40.0 110.423 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -153.43 148.12 26.31 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.475 -0.765 . . . . 40.0 109.149 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.682 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.29 -19.96 20.22 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.465 -0.772 . . . . 40.0 110.211 -179.165 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.518 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.8 t30 69.95 31.19 3.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.448 -0.782 . . . . 40.0 111.889 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.682 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.4 mtm-85 -59.02 -31.15 68.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.821 -1.174 . . . . 40.0 108.129 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.466 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 22.0 mp0 -62.88 -8.92 7.95 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.228 -0.656 . . . . 40.0 109.228 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 58.55 44.05 95.7 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.367 -1.093 . . . . 40.0 110.367 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.664 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.61 -12.29 25.86 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.61 -0.935 . . . . 40.0 108.78 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.603 HD21 ' CD2' ' A' ' 106' ' ' PHE . 28.3 mt -136.2 162.69 55.06 Favored Pre-proline 0 N--CA 1.499 2.024 0 N-CA-C 108.135 -1.061 . . . . 40.0 108.135 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.443 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 93.5 Cg_exo -42.78 142.32 2.14 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 121.98 1.786 . . . . 40.0 112.622 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.609 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.62 -166.42 11.5 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.002 -1.239 . . . . 40.0 110.002 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.5 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.0 pttm 171.5 -158.48 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 107.126 -1.435 . . . . 40.0 107.126 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 67' ' ' SER . 51.0 p -72.4 87.71 1.17 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 107.012 -1.477 . . . . 40.0 107.012 177.013 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.5 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.42 103.97 0.11 Allowed Glycine 0 N--CA 1.498 2.772 0 N-CA-C 109.559 -1.416 . . . . 40.0 109.559 -178.256 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.618 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -124.02 140.85 52.57 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.529 -0.983 . . . . 40.0 110.347 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.64 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 24.1 p -105.99 130.04 54.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.279 -1.008 . . . . 40.0 108.279 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.559 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 31.3 m95 -124.27 140.38 53.02 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.726 -0.789 . . . . 40.0 110.585 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.592 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.7 OUTLIER -143.5 149.55 37.67 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.286 -0.883 . . . . 40.0 108.926 -179.673 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.636 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -116.76 175.34 5.62 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.293 -0.879 . . . . 40.0 112.65 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.527 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -162.24 142.53 10.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.557 -0.715 . . . . 40.0 110.27 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.656 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -67.73 153.17 44.31 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.74 -0.6 . . . . 40.0 110.844 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.518 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 13.8 mm -136.93 151.61 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.382 -0.823 . . . . 40.0 109.798 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.9 m-20 57.27 53.71 7.43 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.143 0.496 . . . . 40.0 111.98 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.576 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 60.3 t80 -118.1 155.14 30.91 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.159 -0.963 . . . . 40.0 109.123 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 42.0 p -133.28 -78.2 0.48 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.716 0.769 . . . . 40.0 109.876 178.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.74 102.94 2.89 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 109.078 -0.712 . . . . 40.0 109.078 -179.546 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -105.95 0.29 Allowed Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.788 -1.325 . . . . 40.0 109.788 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.431 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 14.1 t80 -126.38 -175.83 3.49 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -1.031 . . . . 40.0 109.942 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.432 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.5 mtm180 -84.75 -153.44 0.16 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.417 -0.802 . . . . 40.0 110.38 -178.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -163.7 -135.13 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.759 -0.83 . . . . 40.0 108.759 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' A' ' 100' ' ' THR . 28.1 p -113.84 -10.55 12.96 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.975 -1.078 . . . . 40.0 109.791 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.625 ' OD1' HG22 ' A' ' 100' ' ' THR . 14.1 m-20 -73.91 108.21 6.59 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 120.858 0.361 . . . . 40.0 110.821 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.828 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.03 140.48 45.64 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.469 -0.892 . . . . 40.0 110.391 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.619 HD11 HG21 ' A' ' 96' ' ' ILE . 18.1 tt -111.33 148.33 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 CA-C-O 122.108 0.956 . . . . 40.0 109.917 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.525 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.6 mm? -124.82 128.74 49.18 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.478 -0.764 . . . . 40.0 109.082 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.25 141.58 50.02 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.273 -0.892 . . . . 40.0 109.67 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.559 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.7 p -106.52 179.57 4.23 Favored 'General case' 0 N--CA 1.505 2.314 0 CA-C-O 122.51 1.148 . . . . 40.0 112.666 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.64 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.82 -51.98 58.8 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.381 1.086 . . . . 40.0 109.118 177.863 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.618 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 5.1 1.24 Allowed 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 114.673 -1.149 . . . . 40.0 110.2 -178.955 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.494 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 61.6 m95 72.76 11.52 5.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.882 -0.511 . . . . 40.0 112.097 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' A' ' 95' ' ' LEU . 23.1 mt -67.73 125.14 25.29 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 119.947 -1.72 . . . . 40.0 107.835 178.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 1.02 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.2 mt -112.62 133.25 59.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 122.865 1.317 . . . . 40.0 112.724 -176.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.565 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 16.0 m-85 -125.21 157.68 35.89 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 107.77 -1.196 . . . . 40.0 107.77 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.429 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.92 141.24 51.6 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 119.205 -0.998 . . . . 40.0 112.934 -177.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.83 131.33 40.9 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.484 -1.302 . . . . 40.0 107.484 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.625 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.9 p -116.44 10.35 14.6 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 109.397 -0.594 . . . . 40.0 109.397 -178.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.573 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -115.3 33.16 5.6 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.585 -0.846 . . . . 40.0 109.854 179.293 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 63.98 66.68 0.64 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.262 -0.899 . . . . 40.0 111.071 178.389 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 60.88 43.25 12.03 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.386 -0.821 . . . . 40.0 110.108 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.573 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.4 mm-40 -116.26 -76.92 0.57 Allowed 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.712 -1.243 . . . . 40.0 109.217 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.554 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.9 p -94.81 121.96 36.94 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.664 -1.273 . . . . 40.0 110.433 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.603 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.7 m-85 -102.9 86.14 2.67 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 40.0 110.584 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.5 m -79.28 146.42 32.99 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.197 -1.001 . . . . 40.0 108.334 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.565 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 57.5 tttp -78.28 146.32 34.89 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.304 0.573 . . . . 40.0 110.371 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.788 HD11 ' CG2' ' A' ' 96' ' ' ILE . 29.1 pt -126.97 -31.66 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 N-CA-C 108.933 -0.766 . . . . 40.0 108.933 177.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.633 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.586 -0.721 . . . . 40.0 109.269 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.658 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.7 t . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 109.488 -0.56 . . . . 40.0 109.488 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.538 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.3 mt -137.97 149.74 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.461 -0.774 . . . . 40.0 109.419 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -149.22 36.07 0.74 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.046 -1.034 . . . . 40.0 109.745 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p -119.9 140.51 50.75 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.451 -0.9 . . . . 40.0 110.518 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.581 ' CE2' HG21 ' A' ' 76' ' ' ILE . 74.3 m-85 -41.2 -80.66 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.179 0.514 . . . . 40.0 111.746 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.544 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -50.65 -45.83 58.07 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.566 -0.709 . . . . 40.0 111.108 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.04 -52.0 37.69 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 109.977 -1.249 . . . . 40.0 109.977 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.47 -44.27 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.404 -1.056 . . . . 40.0 109.672 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.823 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.66 -55.04 40.17 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.681 0.753 . . . . 40.0 109.408 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -44.36 88.66 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.953 -0.758 . . . . 40.0 108.953 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.513 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.9 t80 -56.91 -48.24 78.7 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 122.233 1.016 . . . . 40.0 108.52 178.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.537 HD21 ' HA ' ' A' ' 20' ' ' LEU . 39.8 mt -68.73 -45.7 70.82 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.774 -0.579 . . . . 40.0 110.3 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -65.17 -24.34 67.35 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 118.66 -1.216 . . . . 40.0 111.22 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.3 m -98.27 -43.79 6.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.845 -1.159 . . . . 40.0 111.571 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.581 ' C ' ' H ' ' A' ' 19' ' ' LYS . 74.5 m-85 -108.98 -11.98 14.92 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.188 -0.945 . . . . 40.0 111.223 -177.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.497 ' CG ' ' CZ2' ' A' ' 94' ' ' TRP . 2.3 m-70 61.27 -25.62 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 121.567 0.699 . . . . 40.0 111.041 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.588 ' NZ ' ' OD2' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -72.9 121.55 20.19 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 120.313 -1.492 . . . . 40.0 108.988 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.537 ' HA ' HD21 ' A' ' 14' ' ' LEU . 4.0 mt -48.02 129.34 12.07 Favored Pre-proline 0 C--N 1.283 -2.309 0 O-C-N 121.463 -0.773 . . . . 40.0 109.281 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.426 ' O ' ' N ' ' A' ' 23' ' ' ASN . 73.9 Cg_exo -33.62 133.48 0.12 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.624 2.216 . . . . 40.0 113.052 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.588 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -64.0 74.98 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.653 0.739 . . . . 40.0 110.258 -179.354 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.658 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 171.72 18.21 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.719 -0.613 . . . . 40.0 110.322 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -115.28 165.15 13.27 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.601 -0.687 . . . . 40.0 110.735 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -155.93 149.87 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 108.744 -0.835 . . . . 40.0 108.744 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.406 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 69.8 p -69.47 153.68 43.16 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.422 -0.799 . . . . 40.0 110.02 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.29 -51.46 58.44 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.14 -1.43 . . . . 40.0 107.14 177.042 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.8 t -47.36 -62.23 1.53 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.48 -0.763 . . . . 40.0 110.362 178.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 38.9 mt-10 -49.28 -57.2 7.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.356 -0.84 . . . . 40.0 109.356 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.04 -49.43 66.33 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.674 0.749 . . . . 40.0 109.79 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -63.58 -49.59 72.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.728 -0.607 . . . . 40.0 110.16 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.51 -30.02 68.75 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 40.0 110.519 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 mt -66.72 -19.73 65.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.107 -0.996 . . . . 40.0 109.077 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.523 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.74 -1.4 5.14 Favored Glycine 0 N--CA 1.499 2.835 0 C-N-CA 120.073 -1.061 . . . . 40.0 111.143 179.207 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -61.54 114.88 3.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.657 -1.496 . . . . 40.0 109.301 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.8 t -123.32 140.24 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 O-C-N 121.262 -0.899 . . . . 40.0 109.962 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.39 -49.36 78.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 40.0 110.171 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 p -76.64 47.55 0.5 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.218 -0.926 . . . . 40.0 109.425 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -170.89 -49.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.645 -0.659 . . . . 40.0 109.283 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.62 17.4 74.78 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 109.173 -1.571 . . . . 40.0 109.173 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.523 HD21 ' C ' ' A' ' 34' ' ' GLY . 7.4 p-10 -55.61 130.95 45.09 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.455 -1.026 . . . . 40.0 108.946 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.588 HD11 HD11 ' A' ' 51' ' ' ILE . 1.4 tp -169.85 -55.77 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.704 -1.221 . . . . 40.0 107.704 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.76 -27.38 63.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.324 -0.86 . . . . 40.0 110.241 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.02 -57.31 3.95 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.847 0.832 . . . . 40.0 109.455 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.2 m -72.54 -29.4 30.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.955 -1.128 . . . . 40.0 107.955 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.565 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -143.05 79.38 14.48 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 121.557 -0.714 . . . . 40.0 110.306 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.11 54.9 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 122.081 1.854 . . . . 40.0 113.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.12 40.7 0.06 OUTLIER Glycine 0 N--CA 1.503 3.135 0 C-N-CA 119.758 -1.211 . . . . 40.0 111.408 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 15.2 tttt -121.54 138.99 54.07 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.947 -1.325 . . . . 40.0 109.872 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 m -111.99 132.43 54.79 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.032 -1.043 . . . . 40.0 109.283 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.588 HD11 HD11 ' A' ' 42' ' ' LEU . 4.3 mm -63.54 151.29 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.373 -0.829 . . . . 40.0 110.028 -179.114 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.405 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 152.98 144.49 3.92 Favored Glycine 0 N--CA 1.488 2.116 0 C-N-CA 118.789 -1.672 . . . . 40.0 110.651 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 126.79 15.33 2.64 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 119.841 -1.171 . . . . 40.0 111.225 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.565 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -72.79 -170.36 0.69 Allowed 'General case' 0 C--O 1.198 -1.63 0 O-C-N 120.841 -1.388 . . . . 40.0 110.205 -179.291 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 5.6 mm -134.11 138.96 49.27 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-O 121.489 0.662 . . . . 40.0 110.203 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -151.03 148.83 28.83 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.581 -0.699 . . . . 40.0 109.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.693 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.68 -21.16 19.53 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.504 -0.748 . . . . 40.0 110.777 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.509 HD21 ' H ' ' A' ' 63' ' ' LEU . 66.3 t30 71.12 28.12 3.15 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 40.0 111.839 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.693 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.7 mtm-85 -56.64 -32.36 65.27 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.957 -1.089 . . . . 40.0 108.151 178.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.433 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 24.6 mp0 -63.46 -9.22 11.73 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.401 -0.592 . . . . 40.0 109.401 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.93 44.66 97.86 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.236 -1.146 . . . . 40.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.663 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -93.8 -12.85 28.16 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.649 -0.912 . . . . 40.0 108.552 179.679 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.638 HD21 ' CD2' ' A' ' 106' ' ' PHE . 36.5 mt -138.04 166.57 25.01 Favored Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 108.744 -0.836 . . . . 40.0 108.744 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.6 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 81.7 Cg_exo -46.36 136.57 15.11 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 121.862 1.708 . . . . 40.0 112.387 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.622 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -125.81 -168.56 12.7 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.436 -1.466 . . . . 40.0 109.436 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.592 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 4.0 pttm 175.35 -156.28 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 106.867 -1.531 . . . . 40.0 106.867 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.428 ' O ' ' OG ' ' A' ' 67' ' ' SER . 41.2 p -75.85 87.15 2.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.32 -1.487 . . . . 40.0 107.155 177.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.592 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 76.89 105.83 0.15 Allowed Glycine 0 N--CA 1.497 2.756 0 N-CA-C 108.262 -1.935 . . . . 40.0 108.262 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.622 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.1 tpp180 -128.08 142.72 51.13 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.388 -1.066 . . . . 40.0 110.419 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.606 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.75 130.07 55.37 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 108.89 -0.782 . . . . 40.0 108.89 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.6 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 31.3 m95 -123.33 143.57 50.01 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 119.931 -0.708 . . . . 40.0 110.838 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.565 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.6 OUTLIER -145.28 148.47 33.5 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.243 -0.91 . . . . 40.0 109.693 -179.363 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -115.39 169.74 8.93 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.227 -0.92 . . . . 40.0 111.856 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.405 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -156.01 144.37 20.01 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.336 -0.616 . . . . 40.0 109.336 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.643 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -69.59 154.32 42.17 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.621 -0.674 . . . . 40.0 110.631 -178.779 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.581 HG21 ' CE2' ' A' ' 7' ' ' PHE . 16.9 mm -137.08 152.67 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.164 -0.96 . . . . 40.0 109.908 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.498 HD22 ' CG ' ' A' ' 86' ' ' ASP . 74.3 m-20 56.35 57.18 5.11 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.031 0.444 . . . . 40.0 111.492 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.466 ' CG ' ' N ' ' A' ' 79' ' ' THR . 65.1 t80 -120.85 153.66 36.83 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.257 -0.902 . . . . 40.0 109.317 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.2 p -132.55 -78.63 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.888 0.851 . . . . 40.0 109.602 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.44 102.17 2.72 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.855 -0.794 . . . . 40.0 108.855 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.48 -104.92 0.26 Allowed Glycine 0 N--CA 1.498 2.819 0 C-N-CA 119.557 -1.306 . . . . 40.0 109.961 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.1 t80 -126.59 -176.15 3.6 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.638 -0.919 . . . . 40.0 109.453 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.419 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.6 mtm180 -84.19 -150.69 0.12 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.379 -0.826 . . . . 40.0 110.212 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.444 HD21 ' HB2' ' A' ' 86' ' ' ASP . 41.9 p-10 -164.77 -134.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.567 -0.901 . . . . 40.0 108.567 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 26.5 p -115.66 -9.78 11.92 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.048 -1.033 . . . . 40.0 109.681 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.638 ' OD1' HG22 ' A' ' 100' ' ' THR . 20.3 m-20 -75.17 108.76 8.13 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 120.798 0.332 . . . . 40.0 110.821 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.832 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.22 140.15 45.06 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.34 -0.944 . . . . 40.0 109.734 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.666 HD11 HG21 ' A' ' 96' ' ' ILE . 13.8 tt -109.75 148.48 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 CA-C-O 122.019 0.914 . . . . 40.0 110.137 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.583 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.8 mm? -124.18 129.15 50.32 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.768 -0.827 . . . . 40.0 108.768 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.512 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 5.6 p90 -132.53 140.94 48.53 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 109.658 -0.497 . . . . 40.0 109.658 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 71.5 p -107.54 -178.86 3.75 Favored 'General case' 0 N--CA 1.506 2.366 0 CA-C-O 122.292 1.044 . . . . 40.0 112.504 -177.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.606 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -55.5 -50.17 70.65 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 122.193 0.997 . . . . 40.0 109.216 177.493 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.565 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -68.07 1.07 2.99 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.022 -0.99 . . . . 40.0 109.536 -179.375 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 77.2 m95 73.01 17.2 4.2 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 122.089 -0.382 . . . . 40.0 111.116 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.513 ' HA ' HD23 ' A' ' 95' ' ' LEU . 23.4 mt -70.39 125.45 26.85 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.146 -1.428 . . . . 40.0 107.146 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.823 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.6 mp -113.11 133.88 57.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 CA-C-O 122.767 1.27 . . . . 40.0 112.357 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.576 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.1 m-85 -126.75 158.83 35.48 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 107.985 -1.117 . . . . 40.0 107.985 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.431 ' NZ ' ' CZ ' ' A' ' 7' ' ' PHE . 4.8 ptmm? -127.71 142.18 51.4 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.218 -0.993 . . . . 40.0 112.983 -177.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.4 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -132.26 130.84 41.43 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.567 -1.272 . . . . 40.0 107.567 176.813 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.638 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.1 p -115.88 8.51 14.76 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 109.534 -0.543 . . . . 40.0 109.534 -178.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.581 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.74 31.62 6.4 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.845 -0.742 . . . . 40.0 110.016 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 65.22 67.27 0.52 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.104 -0.998 . . . . 40.0 111.04 178.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 61.04 43.0 11.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.409 -0.807 . . . . 40.0 110.398 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.581 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 26.6 mm-40 -116.65 -77.39 0.57 Allowed 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.57 -1.331 . . . . 40.0 109.603 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.519 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 20.4 p -94.61 122.41 37.18 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.98 -1.075 . . . . 40.0 110.096 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.638 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.1 m-85 -103.91 84.87 2.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.558 -0.713 . . . . 40.0 110.385 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.5 m -78.24 143.74 36.83 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.918 -1.114 . . . . 40.0 108.519 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.576 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 58.2 tttp -75.03 143.39 43.55 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.666 -0.646 . . . . 40.0 110.621 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.757 HD11 HG22 ' A' ' 96' ' ' ILE . 31.9 pt -124.29 -29.96 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.798 -0.815 . . . . 40.0 108.798 177.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.554 HH11 ' HG2' ' A' ' 110' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.042 0 CA-C-O 118.719 -0.658 . . . . 40.0 109.304 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.689 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.2 t . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 109.145 -0.687 . . . . 40.0 109.145 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.552 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -139.06 147.61 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.336 -0.853 . . . . 40.0 109.433 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -147.22 33.35 0.89 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.335 -0.853 . . . . 40.0 110.349 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.6 p -117.79 142.17 47.59 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.571 0.701 . . . . 40.0 110.699 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.576 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 66.2 m-85 -42.52 -85.64 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 CA-C-O 122.229 1.014 . . . . 40.0 113.392 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.661 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -45.84 -48.27 15.83 Favored 'General case' 0 C--N 1.285 -2.21 0 O-C-N 121.527 -0.733 . . . . 40.0 109.896 -179.952 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.6 -53.82 23.66 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 110.353 -1.099 . . . . 40.0 110.353 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.9 t -63.99 -44.24 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.349 -1.089 . . . . 40.0 109.725 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 1.09 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.97 -54.2 49.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.915 -1.116 . . . . 40.0 109.961 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -45.43 74.68 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.447 0.641 . . . . 40.0 109.505 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.597 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.7 t80 -56.74 -49.77 74.23 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.063 -1.088 . . . . 40.0 108.063 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.703 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.4 mt -68.29 -44.42 75.53 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.897 -0.721 . . . . 40.0 109.592 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.538 ' HG3' HD11 ' A' ' 96' ' ' ILE . 8.1 mt-30 -65.37 -24.1 67.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.715 -1.241 . . . . 40.0 111.154 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 m -99.9 -50.2 4.09 Favored 'General case' 0 N--CA 1.516 2.842 0 O-C-N 121.106 -0.997 . . . . 40.0 111.809 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.631 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.7 m-85 -98.95 -16.23 18.83 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 120.92 -1.112 . . . . 40.0 111.76 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.703 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.12 -19.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 121.395 0.617 . . . . 40.0 111.206 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.631 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -74.1 118.39 17.0 Favored 'General case' 0 C--N 1.291 -1.961 0 O-C-N 121.295 -0.878 . . . . 40.0 109.822 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.575 ' HA ' HD21 ' A' ' 14' ' ' LEU . 4.8 mt -43.84 128.14 4.17 Favored Pre-proline 0 N--CA 1.498 1.936 0 N-CA-C 107.505 -1.294 . . . . 40.0 107.505 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.468 ' HD2' HD23 ' A' ' 20' ' ' LEU . 52.8 Cg_exo -36.46 134.0 0.33 Allowed 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.008 2.472 . . . . 40.0 112.575 -178.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.627 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -63.76 78.21 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.6 -0.688 . . . . 40.0 110.254 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.689 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 168.24 16.27 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.468 -0.77 . . . . 40.0 110.399 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.417 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.8 m-85 -115.13 166.05 12.25 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 122.021 0.915 . . . . 40.0 110.944 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -155.7 151.25 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.186 -0.947 . . . . 40.0 109.022 178.928 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 53' ' ' GLY . 80.5 p -70.58 154.43 41.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.34 -0.85 . . . . 40.0 110.241 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.62 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.59 -51.72 58.56 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.228 -1.397 . . . . 40.0 107.228 177.138 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.7 t -46.58 -62.94 1.15 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.615 -0.678 . . . . 40.0 110.064 178.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -47.62 -58.15 4.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.408 -0.807 . . . . 40.0 109.435 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.457 ' HB2' HD12 ' A' ' 25' ' ' ILE . . . -52.71 -50.3 63.63 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.493 -0.755 . . . . 40.0 109.526 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.16 -49.86 72.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.849 -0.532 . . . . 40.0 110.768 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.48 -29.62 68.29 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.23 -0.919 . . . . 40.0 110.467 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -17.02 64.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.767 -1.208 . . . . 40.0 109.079 178.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.523 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 128.12 1.18 6.31 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 120.376 -0.916 . . . . 40.0 111.434 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -64.25 115.56 5.15 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.469 -1.606 . . . . 40.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 51.8 t -122.97 143.29 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 121.355 -0.841 . . . . 40.0 110.401 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.84 -49.09 76.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.572 -0.705 . . . . 40.0 109.97 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 p -78.69 50.62 1.0 Allowed 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.698 -0.853 . . . . 40.0 108.698 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 tttp -172.83 -51.44 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.738 -0.838 . . . . 40.0 108.738 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.99 20.33 76.15 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 108.939 -1.665 . . . . 40.0 108.939 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.523 HD21 ' C ' ' A' ' 34' ' ' GLY . 6.2 p-10 -55.73 128.08 33.1 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.987 -0.746 . . . . 40.0 108.987 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.678 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.1 tp -166.86 -56.65 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.917 0.865 . . . . 40.0 109.074 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.39 -28.57 59.65 Favored 'General case' 0 C--N 1.289 -2.039 0 O-C-N 121.14 -0.975 . . . . 40.0 110.384 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.5 -62.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.532 -0.73 . . . . 40.0 109.299 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.409 ' H ' HG22 ' A' ' 45' ' ' VAL . 14.7 m -69.41 -29.66 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 CA-C-O 121.543 0.687 . . . . 40.0 109.977 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.599 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -142.93 78.55 15.35 Favored Pre-proline 0 C--N 1.299 -1.589 0 O-C-N 121.193 -0.942 . . . . 40.0 109.116 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -56.14 51.33 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 122.349 2.033 . . . . 40.0 114.685 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.25 0.06 OUTLIER Glycine 0 N--CA 1.502 3.087 0 C-N-CA 119.463 -1.351 . . . . 40.0 111.112 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 23.8 tttt -122.92 146.19 47.81 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.757 -1.437 . . . . 40.0 109.329 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.417 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 7.6 m -117.3 131.77 56.74 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.708 -1.245 . . . . 40.0 110.848 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.478 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 8.0 mm -60.27 149.14 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-O 121.63 0.728 . . . . 40.0 110.866 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.419 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 151.94 147.1 4.49 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.152 -1.499 . . . . 40.0 110.916 179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.443 ' O ' HG22 ' A' ' 26' ' ' THR . . . 123.32 17.95 3.17 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.682 -0.77 . . . . 40.0 111.603 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.606 ' OD2' ' NZ ' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -74.21 -169.56 0.81 Allowed 'General case' 0 C--O 1.195 -1.774 0 O-C-N 120.801 -1.411 . . . . 40.0 110.074 -179.331 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.19 139.13 50.01 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.801 0 CA-C-O 121.761 0.791 . . . . 40.0 110.2 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -150.3 147.79 28.06 Favored 'General case' 0 C--N 1.293 -1.882 0 C-N-CA 119.926 -0.71 . . . . 40.0 109.96 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.702 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -95.06 -16.66 22.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.818 -0.551 . . . . 40.0 110.03 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.51 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 67.1 t30 68.11 28.46 6.6 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 40.0 111.785 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.702 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.3 mtm-85 -56.78 -31.82 65.03 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.919 -1.113 . . . . 40.0 108.475 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.45 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 21.1 mp0 -61.85 -13.02 20.43 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.344 -0.613 . . . . 40.0 109.344 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.63 43.89 98.33 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.839 -1.304 . . . . 40.0 109.839 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.644 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -94.47 -12.36 27.86 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.476 -0.935 . . . . 40.0 108.476 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.581 HD21 ' CD2' ' A' ' 106' ' ' PHE . 31.9 mt -136.26 163.75 47.81 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 109.014 -0.736 . . . . 40.0 109.014 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.569 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 92.1 Cg_exo -43.26 137.61 5.06 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.987 1.791 . . . . 40.0 112.366 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.539 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.19 -169.5 12.51 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.065 -1.214 . . . . 40.0 110.065 -178.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.469 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.9 ptmm? 173.9 -158.81 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.138 -1.43 . . . . 40.0 107.138 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 67' ' ' SER . 24.4 p -73.33 88.51 1.55 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.034 -1.469 . . . . 40.0 107.034 177.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.469 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 74.79 103.98 0.09 OUTLIER Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.016 -1.634 . . . . 40.0 109.016 -177.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.607 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.0 tpp180 -125.41 143.06 51.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.942 -0.74 . . . . 40.0 109.467 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.639 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 35.2 p -109.78 133.24 53.37 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.832 -1.173 . . . . 40.0 107.832 178.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.608 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 32.7 m95 -127.17 141.37 51.76 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.815 0.817 . . . . 40.0 110.474 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.629 HH12 ' HA ' ' A' ' 92' ' ' SER . 1.0 OUTLIER -144.89 146.67 32.13 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.54 -0.725 . . . . 40.0 109.378 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.62 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -113.93 172.97 6.66 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.154 -0.966 . . . . 40.0 112.354 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -159.22 143.7 15.42 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.766 -0.584 . . . . 40.0 109.734 179.146 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.617 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.69 156.37 35.45 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.471 -0.768 . . . . 40.0 110.617 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.576 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 13.8 mm -139.69 152.13 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 40.0 109.463 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.505 HD22 ' CG ' ' A' ' 86' ' ' ASP . 70.7 m-20 56.29 54.93 7.15 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.117 -0.492 . . . . 40.0 111.616 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.678 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 52.7 t80 -116.72 155.49 28.78 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.997 -1.065 . . . . 40.0 108.968 177.571 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.577 ' OG1' ' N ' ' A' ' 80' ' ' SER . 32.9 p -132.84 -78.08 0.49 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.82 0.819 . . . . 40.0 109.904 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.577 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.0 OUTLIER -152.47 102.73 2.76 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.155 -1.054 . . . . 40.0 108.155 -179.568 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 151.87 -108.16 0.36 Allowed Glycine 0 N--CA 1.501 3.022 0 N-CA-C 109.762 -1.335 . . . . 40.0 109.762 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.487 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 20.1 t80 -124.67 -178.06 4.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.304 -1.115 . . . . 40.0 109.357 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.487 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 1.3 mtm180 -83.44 -151.49 0.11 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.795 0.807 . . . . 40.0 110.806 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.413 HD21 ' HB2' ' A' ' 77' ' ' ASN . 40.5 p30 -164.6 -133.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.782 -0.822 . . . . 40.0 108.782 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' SER . . . . . 0.482 ' OG ' ' O ' ' A' ' 100' ' ' THR . 24.5 p -116.08 -9.88 11.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.033 -1.042 . . . . 40.0 110.249 -179.074 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.655 ' OD1' HG22 ' A' ' 100' ' ' THR . 17.9 m-20 -74.65 110.9 9.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 122.172 -0.33 . . . . 40.0 110.595 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.831 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -137.15 140.14 41.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.237 -0.914 . . . . 40.0 109.83 179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.629 ' O ' HD22 ' A' ' 89' ' ' LEU . 11.1 tt -110.35 148.79 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 122.389 1.09 . . . . 40.0 110.205 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.629 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -125.62 128.01 47.2 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.663 -0.648 . . . . 40.0 109.323 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.524 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.46 142.61 50.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.479 -0.763 . . . . 40.0 109.249 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.608 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 90.0 p -107.34 178.51 4.52 Favored 'General case' 0 N--CA 1.504 2.241 0 CA-C-O 122.128 0.966 . . . . 40.0 112.679 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.639 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.42 -51.86 56.91 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-O 122.176 0.988 . . . . 40.0 109.059 177.625 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.607 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.03 5.24 1.22 Allowed 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 114.87 -1.059 . . . . 40.0 109.742 -179.002 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.588 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 77.1 m95 69.53 19.69 7.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 122.05 -0.406 . . . . 40.0 111.608 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.518 ' HA ' HD23 ' A' ' 95' ' ' LEU . 21.7 mt -72.87 127.61 33.05 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.285 -1.746 . . . . 40.0 106.285 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 1.09 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.4 mp -112.97 135.99 50.67 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.103 0 CA-C-O 122.914 1.34 . . . . 40.0 111.751 -177.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.628 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.9 m-85 -127.72 158.08 38.59 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 107.75 -1.204 . . . . 40.0 107.75 178.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.427 ' HD2' ' CG2' ' A' ' 109' ' ' ILE . 6.0 ptmm? -127.08 142.64 51.47 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.056 -1.027 . . . . 40.0 112.124 -178.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.48 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.86 129.89 37.08 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.973 -1.491 . . . . 40.0 106.973 178.151 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.655 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.4 p -117.07 9.07 13.51 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 109.506 -0.553 . . . . 40.0 109.506 -177.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.569 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.97 33.4 5.25 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.584 -0.846 . . . . 40.0 109.772 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 64.58 66.27 0.6 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.042 -1.036 . . . . 40.0 110.826 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 60.7 42.74 13.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.479 -0.763 . . . . 40.0 110.408 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.569 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.2 mm-40 -115.53 -77.64 0.57 Allowed 'General case' 0 N--CA 1.509 2.49 0 O-C-N 120.701 -1.249 . . . . 40.0 109.551 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.536 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 19.7 p -93.03 121.1 34.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.606 -1.309 . . . . 40.0 110.177 -178.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.581 ' CD2' HD21 ' A' ' 63' ' ' LEU . 6.7 m-85 -102.33 83.7 2.36 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.644 -0.66 . . . . 40.0 110.911 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.1 m -76.35 144.35 40.18 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 122.106 0.955 . . . . 40.0 109.344 177.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.628 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 57.8 tttp -76.8 146.13 38.04 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 121.496 -0.753 . . . . 40.0 110.031 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.778 HD11 HG22 ' A' ' 96' ' ' ILE . 31.8 pt -127.61 -31.54 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 120.049 -0.66 . . . . 40.0 109.305 178.297 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.661 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.501 2.121 0 N-CA-C 108.817 -0.809 . . . . 40.0 108.817 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.649 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.542 -0.54 . . . . 40.0 109.542 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.587 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.12 146.49 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.648 -0.658 . . . . 40.0 109.463 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -148.67 32.69 0.78 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.114 -0.991 . . . . 40.0 109.305 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.0 p -119.54 141.56 49.12 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.502 -0.879 . . . . 40.0 110.58 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.562 ' CE2' HG21 ' A' ' 76' ' ' ILE . 58.9 m-85 -41.84 -87.37 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 N-CA-C 113.486 0.921 . . . . 40.0 113.486 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.658 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -47.57 -46.16 27.75 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.316 -0.865 . . . . 40.0 109.878 -179.494 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.87 47.95 Favored Glycine 0 N--CA 1.497 2.708 0 N-CA-C 110.043 -1.223 . . . . 40.0 110.043 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.44 -43.88 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.124 -1.221 . . . . 40.0 109.368 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.828 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -57.2 -54.6 44.96 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.557 0.694 . . . . 40.0 109.785 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -49.18 67.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.558 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.1 t80 -51.81 -51.31 57.39 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.952 0.882 . . . . 40.0 109.309 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.603 HD21 ' HA ' ' A' ' 20' ' ' LEU . 66.0 mt -70.04 -45.77 66.46 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.725 -0.61 . . . . 40.0 111.463 -179.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -62.64 -24.2 67.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.853 -1.154 . . . . 40.0 110.568 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.5 m -101.66 -49.22 4.06 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 120.481 -1.387 . . . . 40.0 111.182 -178.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.55 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.4 m-85 -101.64 -14.05 17.57 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.525 -0.735 . . . . 40.0 110.784 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.536 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.8 m-70 61.78 -25.72 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.096 -1.002 . . . . 40.0 111.788 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.588 ' NZ ' ' OD2' ' A' ' 22' ' ' ASP . 0.4 OUTLIER -73.8 123.76 24.78 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.518 -1.364 . . . . 40.0 109.847 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.617 HD23 ' HD2' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -48.65 128.86 13.9 Favored Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.426 -0.796 . . . . 40.0 109.339 179.013 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.617 ' HD2' HD23 ' A' ' 20' ' ' LEU . 46.4 Cg_exo -37.62 131.28 0.72 Allowed 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.411 2.074 . . . . 40.0 112.08 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -63.34 78.4 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.838 0.828 . . . . 40.0 110.11 -179.108 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.649 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 170.26 14.44 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.861 -0.524 . . . . 40.0 110.759 -179.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.432 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.9 m-85 -114.17 164.82 13.36 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.84 0.829 . . . . 40.0 111.834 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.79 150.28 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.345 -0.847 . . . . 40.0 109.695 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.433 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 68.2 p -73.07 150.54 42.23 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.227 -0.92 . . . . 40.0 108.708 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.645 ' NZ ' ' OD1' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -48.29 -53.09 18.52 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.802 -1.185 . . . . 40.0 107.802 178.321 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.0 t -46.33 -62.2 1.46 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.445 -0.784 . . . . 40.0 110.714 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.433 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 36.1 mt-10 -50.73 -56.07 13.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.874 -1.141 . . . . 40.0 109.009 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.83 -51.07 59.26 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.264 -0.898 . . . . 40.0 109.768 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.79 -48.35 77.23 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.844 -0.535 . . . . 40.0 110.829 -179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -30.67 69.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.368 -0.833 . . . . 40.0 110.467 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.67 -18.49 64.28 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.17 -0.956 . . . . 40.0 108.759 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.585 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 130.6 -0.7 5.52 Favored Glycine 0 N--CA 1.503 3.157 0 C-N-CA 120.192 -1.004 . . . . 40.0 111.02 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -62.84 113.29 2.96 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.544 -1.563 . . . . 40.0 109.074 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -122.09 141.86 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.344 -0.847 . . . . 40.0 111.032 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.13 -47.32 86.78 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.18 -0.95 . . . . 40.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.5 p -78.52 49.95 0.91 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.735 -1.228 . . . . 40.0 109.258 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -174.27 -49.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.204 -0.665 . . . . 40.0 109.204 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.02 24.42 73.15 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.194 -1.562 . . . . 40.0 109.194 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.585 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.7 p-10 -57.18 130.17 45.0 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.762 -0.846 . . . . 40.0 108.803 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.746 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 6.2 tp -169.34 -56.81 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.932 -0.766 . . . . 40.0 108.932 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.46 -27.18 35.69 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.751 -1.218 . . . . 40.0 109.803 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.42 -66.14 0.81 Allowed 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.583 0.706 . . . . 40.0 109.629 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.0 m -69.06 -27.13 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.475 -0.766 . . . . 40.0 110.615 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.663 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -143.82 78.35 14.22 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.936 . . . . 40.0 108.494 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -59.42 54.15 0.07 OUTLIER 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 123.409 2.74 . . . . 40.0 113.644 -178.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.34 40.85 0.07 OUTLIER Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.505 -1.331 . . . . 40.0 110.39 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.663 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 26.8 tttt -120.72 148.66 43.65 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.265 -1.138 . . . . 40.0 110.403 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 4.4 m -120.86 132.0 54.73 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.115 -0.991 . . . . 40.0 110.726 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 1.7 mm -65.05 155.43 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 CA-C-O 122.55 1.167 . . . . 40.0 111.015 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.544 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.84 154.4 6.4 Favored Glycine 0 N--CA 1.483 1.798 0 N-CA-C 109.15 -1.58 . . . . 40.0 109.15 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.411 ' O ' HG22 ' A' ' 26' ' ' THR . . . 117.44 18.15 5.43 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 119.859 -1.162 . . . . 40.0 111.111 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.645 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -76.58 -170.13 1.44 Allowed 'General case' 0 C--O 1.192 -1.923 0 O-C-N 120.607 -1.525 . . . . 40.0 109.758 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.0 mm -132.84 138.25 52.21 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.024 0 CA-C-O 121.798 0.809 . . . . 40.0 110.257 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -149.92 149.0 29.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.757 -0.589 . . . . 40.0 110.021 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.694 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.59 -17.93 21.86 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.806 -0.559 . . . . 40.0 110.318 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.545 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.9 t30 66.59 27.07 9.68 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.127 -0.983 . . . . 40.0 111.666 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.694 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.0 OUTLIER -55.37 -31.61 61.92 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.2 -1.037 . . . . 40.0 108.2 178.096 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.435 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 21.6 mp0 -64.69 -8.37 14.33 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 108.999 -0.741 . . . . 40.0 108.999 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.15 43.76 98.05 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 110.28 -1.128 . . . . 40.0 110.28 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.654 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -91.8 -13.64 31.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.38 -1.07 . . . . 40.0 109.074 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.545 ' H ' HD21 ' A' ' 58' ' ' ASN . 25.0 mt -135.25 167.43 22.61 Favored Pre-proline 0 N--CA 1.499 1.991 0 N-CA-C 108.299 -1.0 . . . . 40.0 108.299 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.635 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 88.1 Cg_exo -47.21 141.95 12.59 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.595 1.53 . . . . 40.0 112.344 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.649 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.95 -166.9 11.58 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 110.448 -1.061 . . . . 40.0 110.448 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.561 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.8 pttm 172.96 -156.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 106.807 -1.553 . . . . 40.0 106.807 -178.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.43 ' O ' ' OG ' ' A' ' 67' ' ' SER . 57.0 p -75.42 86.44 2.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.656 -1.278 . . . . 40.0 107.901 177.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.561 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.15 99.19 0.31 Allowed Glycine 0 N--CA 1.498 2.802 0 N-CA-C 108.665 -1.774 . . . . 40.0 108.665 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.649 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 17.0 tpp180 -122.56 140.12 53.14 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.349 -1.089 . . . . 40.0 109.878 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.638 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 31.4 p -107.26 131.32 54.33 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 108.212 -1.033 . . . . 40.0 108.212 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.635 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.3 m95 -126.0 141.57 51.9 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.761 -0.776 . . . . 40.0 110.846 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.648 ' HB2' ' CZ ' ' A' ' 90' ' ' TYR . 0.4 OUTLIER -143.8 148.74 36.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.196 -0.94 . . . . 40.0 109.306 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.588 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -113.71 175.48 5.44 Favored 'General case' 0 C--N 1.31 -1.125 0 O-C-N 120.983 -1.073 . . . . 40.0 113.14 -178.715 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.544 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -161.44 139.29 9.18 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.654 -0.654 . . . . 40.0 110.584 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.637 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.17 154.42 39.81 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.5 -0.75 . . . . 40.0 110.232 -179.562 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.562 HG21 ' CE2' ' A' ' 7' ' ' PHE . 18.3 mm -138.11 152.61 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.174 -0.954 . . . . 40.0 109.381 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.514 HD22 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 56.64 56.29 5.68 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.04 0.447 . . . . 40.0 111.505 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.746 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 65.9 t80 -120.51 154.51 35.2 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.936 -1.102 . . . . 40.0 109.129 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.618 ' OG1' ' N ' ' A' ' 80' ' ' SER . 43.5 p -133.32 -79.49 0.48 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 122.036 0.922 . . . . 40.0 109.49 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.618 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.84 103.55 2.78 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 115.314 -0.857 . . . . 40.0 110.027 -179.092 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.79 -104.58 0.26 Allowed Glycine 0 N--CA 1.501 2.983 0 N-CA-C 108.713 -1.755 . . . . 40.0 108.713 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 15.3 t80 -125.93 -175.46 3.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.534 -0.98 . . . . 40.0 109.429 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.443 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.5 mtm180 -83.68 -149.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.804 . . . . 40.0 109.728 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.442 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.4 p30 -165.02 -134.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.108 -1.071 . . . . 40.0 108.108 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 29.9 p -116.0 -9.18 11.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.773 -1.204 . . . . 40.0 109.978 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.637 ' OD1' HG22 ' A' ' 100' ' ' THR . 23.9 m-20 -74.33 108.77 7.32 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 122.195 -0.316 . . . . 40.0 110.558 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.829 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.07 137.07 42.52 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.114 -0.991 . . . . 40.0 110.422 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.63 HD11 HG21 ' A' ' 96' ' ' ILE . 14.6 tt -106.98 146.51 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 CA-C-O 122.108 0.956 . . . . 40.0 110.858 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.54 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.8 mm? -124.32 129.78 51.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 40.0 108.808 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.648 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 21.8 p90 -132.65 142.03 48.91 Favored 'General case' 0 N--CA 1.515 2.792 0 N-CA-C 109.528 -0.545 . . . . 40.0 109.528 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.585 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.8 p -108.07 -178.71 3.69 Favored 'General case' 0 N--CA 1.506 2.349 0 CA-C-O 122.248 1.023 . . . . 40.0 113.109 -176.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.638 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.12 -52.66 57.96 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.502 1.144 . . . . 40.0 108.45 178.31 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.55 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -67.67 3.72 1.32 Allowed 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.348 -1.297 . . . . 40.0 110.116 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.484 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 73.2 m95 71.55 15.48 6.07 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.823 -0.548 . . . . 40.0 111.789 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.518 ' HA ' HD23 ' A' ' 95' ' ' LEU . 21.0 mt -69.38 127.39 32.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.26 -1.525 . . . . 40.0 106.916 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.828 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mp -113.13 135.33 52.98 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 CA-C-O 122.824 1.297 . . . . 40.0 111.347 -177.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.543 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 14.0 m-85 -127.33 159.8 33.3 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.938 -1.504 . . . . 40.0 106.938 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.456 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 4.5 ptmm? -128.45 142.8 50.98 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 119.028 -1.069 . . . . 40.0 112.731 -178.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 131.77 40.84 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 107.616 -1.253 . . . . 40.0 107.616 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.637 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.7 p -116.82 9.52 13.92 Favored 'General case' 0 N--CA 1.51 2.551 0 N-CA-C 109.699 -0.482 . . . . 40.0 109.699 -177.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.617 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -114.72 36.2 3.93 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.496 -0.882 . . . . 40.0 109.341 179.196 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.69 69.32 0.69 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.15 -0.968 . . . . 40.0 110.977 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 58.92 45.87 14.54 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.449 -0.782 . . . . 40.0 110.445 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.617 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 31.5 mm-40 -118.82 -78.73 0.59 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.742 -1.224 . . . . 40.0 109.083 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.521 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.0 p -93.84 121.95 35.82 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 120.849 -1.157 . . . . 40.0 110.183 -178.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.543 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -102.91 84.15 2.33 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.571 -0.706 . . . . 40.0 110.881 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.4 m -77.77 142.29 38.75 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.822 -1.174 . . . . 40.0 108.977 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.543 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 60.7 tttp -75.08 144.93 42.71 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.856 -0.528 . . . . 40.0 110.705 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.652 HD11 HG22 ' A' ' 96' ' ' ILE . 26.9 pt -127.49 -28.86 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 109.166 -0.679 . . . . 40.0 109.166 177.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.658 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.066 0 N-CA-C 108.861 -0.792 . . . . 40.0 108.861 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.685 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.0 t . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.347 -0.612 . . . . 40.0 109.347 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.604 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.7 mt -139.01 146.06 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.373 -0.83 . . . . 40.0 109.709 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.9 p-10 -147.52 32.88 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.089 -1.007 . . . . 40.0 109.765 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -118.87 140.94 49.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.949 0.88 . . . . 40.0 110.287 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.505 ' CE2' HG21 ' A' ' 76' ' ' ILE . 60.0 m-85 -41.17 -85.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 113.033 0.753 . . . . 40.0 113.033 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.642 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -48.37 -45.66 35.94 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.744 -0.598 . . . . 40.0 109.851 -178.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.74 -52.11 31.01 Favored Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.495 -1.042 . . . . 40.0 110.495 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 51.3 t -65.77 -45.08 92.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -1.211 . . . . 40.0 109.726 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 1.051 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.06 -56.98 15.03 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.626 0.727 . . . . 40.0 110.168 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.49 -49.58 67.19 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.965 -0.754 . . . . 40.0 108.965 178.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.633 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 16.6 t80 -51.85 -50.85 60.12 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.179 0.99 . . . . 40.0 109.02 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.56 HD22 ' HZ3' ' A' ' 94' ' ' TRP . 29.3 mt -66.37 -47.16 74.29 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 115.918 -0.583 . . . . 40.0 110.713 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.429 ' HG3' HD11 ' A' ' 96' ' ' ILE . 23.0 mt-30 -64.13 -21.67 66.64 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.196 -0.94 . . . . 40.0 111.531 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.2 m -105.11 -46.02 4.36 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.875 -1.14 . . . . 40.0 111.811 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.577 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.5 m-85 -100.37 -17.12 17.38 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.145 -0.972 . . . . 40.0 110.919 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.5 m-70 61.97 -29.02 0.07 Allowed 'General case' 0 N--CA 1.505 2.3 0 CA-C-O 121.668 0.746 . . . . 40.0 111.282 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.633 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.47 115.96 12.36 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 120.93 -1.106 . . . . 40.0 108.741 179.503 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.647 HD23 ' HD2' ' A' ' 21' ' ' PRO . 0.9 OUTLIER -42.9 129.92 3.16 Favored Pre-proline 0 N--CA 1.5 2.029 0 N-CA-C 108.846 -0.798 . . . . 40.0 108.846 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.647 ' HD2' HD23 ' A' ' 20' ' ' LEU . 74.2 Cg_exo -35.47 134.82 0.21 Allowed 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.741 2.294 . . . . 40.0 112.94 -179.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.59 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -64.32 73.86 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 121.862 0.839 . . . . 40.0 110.302 -179.011 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.685 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 172.19 16.34 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.606 -0.684 . . . . 40.0 111.367 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.518 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 12.5 m-85 -113.57 164.64 13.39 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.311 -0.868 . . . . 40.0 111.034 -178.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -153.91 149.94 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.333 -0.855 . . . . 40.0 109.562 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.2 p -70.6 151.38 45.06 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.671 -0.643 . . . . 40.0 109.509 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.659 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -50.58 -51.76 45.35 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 107.715 -1.217 . . . . 40.0 107.715 177.226 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -47.14 -61.85 1.69 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.614 -0.679 . . . . 40.0 110.473 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -49.76 -57.13 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.089 -1.007 . . . . 40.0 108.939 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.93 58.9 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-O 121.632 0.73 . . . . 40.0 109.656 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -64.34 -48.22 76.37 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.829 -0.544 . . . . 40.0 110.985 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.32 -31.08 70.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.259 -0.901 . . . . 40.0 109.957 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.8 -20.11 65.88 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.187 -0.945 . . . . 40.0 108.951 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.564 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 130.99 -1.89 5.5 Favored Glycine 0 N--CA 1.501 2.986 0 N-CA-C 110.863 -0.895 . . . . 40.0 110.863 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -60.07 116.52 4.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.585 -1.538 . . . . 40.0 109.034 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 43.2 t -123.88 143.7 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 CA-C-O 121.735 0.778 . . . . 40.0 110.523 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.8 77.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.244 -0.91 . . . . 40.0 109.812 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.9 p -79.16 51.08 1.13 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.86 -1.15 . . . . 40.0 109.06 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -173.3 -50.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 108.924 -0.769 . . . . 40.0 108.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.39 21.68 72.51 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 108.805 -1.718 . . . . 40.0 108.805 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.564 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -56.79 132.02 51.04 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.85 -0.794 . . . . 40.0 109.059 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.565 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 6.1 tp -169.97 -57.2 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.995 -1.113 . . . . 40.0 107.995 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.22 -23.75 49.96 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.683 -0.636 . . . . 40.0 110.768 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.425 ' OD2' HG13 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -76.86 -64.41 1.13 Allowed 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.709 -0.849 . . . . 40.0 108.709 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.425 HG13 ' OD2' ' A' ' 44' ' ' ASP . 27.5 m -68.87 -27.05 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.534 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -144.62 79.69 12.22 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.571 -0.705 . . . . 40.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -59.26 55.88 0.06 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.713 2.275 . . . . 40.0 114.105 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.95 43.83 0.06 OUTLIER Glycine 0 N--CA 1.502 3.039 0 C-N-CA 120.104 -1.046 . . . . 40.0 111.152 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 19.2 tttt -122.89 146.18 47.8 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.771 -1.429 . . . . 40.0 109.585 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.6 m -116.21 136.97 52.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 40.0 109.808 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.429 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 7.4 mm -66.49 151.86 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 CA-C-O 121.241 0.543 . . . . 40.0 109.606 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 150.41 145.72 4.18 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 118.924 -1.607 . . . . 40.0 110.88 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.77 15.86 3.13 Favored Glycine 0 N--CA 1.494 2.56 0 O-C-N 121.305 -1.115 . . . . 40.0 111.388 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.659 ' CG ' ' HZ2' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -72.11 -169.65 0.52 Allowed 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.151 -1.205 . . . . 40.0 110.356 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.401 HG12 ' C ' ' A' ' 54' ' ' ASP . 1.1 mm -133.49 138.14 51.61 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.62 0 CA-C-O 121.459 0.647 . . . . 40.0 109.627 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -150.41 146.84 26.93 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.426 -0.796 . . . . 40.0 109.63 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.686 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -91.16 -21.83 20.97 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.691 -0.631 . . . . 40.0 110.174 179.737 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.605 HD21 ' H ' ' A' ' 63' ' ' LEU . 64.6 t30 72.33 26.69 2.62 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.265 -0.897 . . . . 40.0 111.588 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.686 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.2 mtm-85 -55.32 -31.86 62.01 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.969 -1.082 . . . . 40.0 108.461 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.432 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.2 mp0 -62.9 -10.48 13.58 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.063 -0.717 . . . . 40.0 109.063 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.27 45.42 96.51 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 110.402 -1.079 . . . . 40.0 110.402 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.649 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.28 -13.21 25.04 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.579 -0.953 . . . . 40.0 109.741 -179.785 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.615 HD21 ' CD2' ' A' ' 106' ' ' PHE . 24.7 mt -136.77 163.72 47.56 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.15 -1.056 . . . . 40.0 108.15 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.471 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 91.5 Cg_exo -42.62 141.59 2.31 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 122.449 2.099 . . . . 40.0 112.814 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.468 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.97 -171.02 12.71 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 110.788 -0.925 . . . . 40.0 110.788 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.439 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 ptmm? 177.09 -157.77 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.213 -1.403 . . . . 40.0 107.213 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' OG ' ' A' ' 67' ' ' SER . 53.1 p -75.08 84.91 2.32 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 107.134 -1.432 . . . . 40.0 107.134 177.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.439 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.91 99.33 0.35 Allowed Glycine 0 N--CA 1.497 2.726 0 N-CA-C 108.954 -1.658 . . . . 40.0 108.954 -178.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.606 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.1 tpp180 -121.14 142.68 49.64 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.587 -0.949 . . . . 40.0 110.175 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.638 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.99 128.66 55.14 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.341 -0.985 . . . . 40.0 108.341 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.531 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 34.5 m95 -120.54 142.3 49.46 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.062 -1.024 . . . . 40.0 110.814 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.594 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.2 mpp_? -141.22 146.89 37.47 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.462 -0.773 . . . . 40.0 109.986 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.641 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -116.72 169.84 9.05 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 121.184 -0.948 . . . . 40.0 111.983 -179.87 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.518 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -157.49 145.31 18.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.561 -0.712 . . . . 40.0 109.747 178.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.645 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.24 154.63 41.69 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.524 -0.735 . . . . 40.0 109.474 -178.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.505 HG21 ' CE2' ' A' ' 7' ' ' PHE . 15.0 mm -137.34 149.9 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.103 -0.998 . . . . 40.0 109.653 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.471 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.6 m-20 59.69 57.11 3.32 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.144 0.497 . . . . 40.0 111.016 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.565 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 60.6 t80 -121.51 153.83 37.44 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.17 -0.956 . . . . 40.0 109.025 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.61 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.0 p -132.29 -79.81 0.5 Allowed 'General case' 0 N--CA 1.5 2.03 0 CA-C-O 121.833 0.825 . . . . 40.0 109.937 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.61 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.99 99.92 2.59 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 108.723 -0.843 . . . . 40.0 108.723 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.17 -107.71 0.34 Allowed Glycine 0 N--CA 1.496 2.655 0 N-CA-C 109.953 -1.259 . . . . 40.0 109.953 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.471 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 19.5 t80 -123.43 -178.98 4.16 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.343 -1.093 . . . . 40.0 110.299 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.471 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -83.28 -153.45 0.13 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.744 0.783 . . . . 40.0 110.306 -179.249 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.413 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.7 p30 -162.92 -133.66 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.356 -0.979 . . . . 40.0 108.356 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 100' ' ' THR . 52.9 p -115.39 -10.35 12.01 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.997 -1.064 . . . . 40.0 109.706 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.606 ' OD1' HG22 ' A' ' 100' ' ' THR . 14.1 m-20 -72.57 108.3 5.54 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 120.834 0.35 . . . . 40.0 110.078 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.789 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.02 137.61 41.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.124 -1.03 . . . . 40.0 110.502 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.638 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.6 tt -107.99 148.01 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 122.509 1.147 . . . . 40.0 110.896 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.638 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -125.48 127.3 46.27 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.704 -0.85 . . . . 40.0 108.704 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.594 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.9 p90 -131.48 141.38 49.76 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.682 -0.858 . . . . 40.0 108.682 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.531 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 61.7 p -107.3 178.73 4.46 Favored 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 122.114 0.959 . . . . 40.0 112.155 -177.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.638 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -50.7 -54.04 26.41 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.37 1.081 . . . . 40.0 108.526 177.381 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.606 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -66.02 3.56 0.82 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.694 -1.139 . . . . 40.0 110.389 -179.153 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.56 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 64.9 m95 72.44 13.35 5.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.711 -0.618 . . . . 40.0 111.935 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.47 127.16 31.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 119.896 -1.752 . . . . 40.0 107.428 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 1.051 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mt -114.24 132.8 62.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-O 122.552 1.168 . . . . 40.0 112.529 -177.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.487 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.4 m-85 -125.26 157.08 37.49 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 114.335 -1.302 . . . . 40.0 107.564 178.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.424 ' NZ ' ' CZ ' ' A' ' 7' ' ' PHE . 5.6 ptmm? -128.03 141.54 51.48 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.027 -1.069 . . . . 40.0 112.36 -177.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.423 ' HB ' ' O ' ' A' ' 105' ' ' THR . 0.0 OUTLIER -131.1 132.66 44.99 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 107.128 -1.434 . . . . 40.0 107.128 177.248 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.606 HG22 ' OD1' ' A' ' 86' ' ' ASP . 2.8 p -117.89 9.3 12.83 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 109.449 -0.574 . . . . 40.0 109.449 -178.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.531 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.63 35.11 4.19 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 119.672 -0.811 . . . . 40.0 109.765 179.16 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.13 68.05 0.76 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.21 -0.931 . . . . 40.0 111.036 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 60.53 42.57 14.04 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.793 -0.567 . . . . 40.0 110.778 178.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.531 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.9 mm-40 -114.63 -76.95 0.57 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.732 -1.23 . . . . 40.0 109.655 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.486 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.0 p -93.83 126.03 38.79 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.622 -1.299 . . . . 40.0 110.669 -178.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.615 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.8 m-85 -105.85 85.98 2.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.593 -0.692 . . . . 40.0 110.807 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.5 m -77.89 144.87 36.57 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.25 -0.98 . . . . 40.0 108.793 177.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 58.8 tttp -77.21 147.92 36.15 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.609 -0.682 . . . . 40.0 110.151 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.747 HD11 ' CG2' ' A' ' 96' ' ' ILE . 23.2 pt -127.21 -35.46 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 N-CA-C 108.443 -0.947 . . . . 40.0 108.443 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.642 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.11 0 O-C-N 121.565 -0.709 . . . . 40.0 109.576 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.655 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.3 t . . . . . 0 N--CA 1.494 1.765 0 N-CA-C 109.132 -0.692 . . . . 40.0 109.132 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.571 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 9.5 mt -135.78 147.22 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.473 -0.767 . . . . 40.0 109.599 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -147.73 29.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.99 -1.068 . . . . 40.0 109.734 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.4 p -116.48 143.05 46.07 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 119.68 -0.808 . . . . 40.0 110.732 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.514 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 59.7 m-85 -42.95 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.372 0 N-CA-C 112.781 0.66 . . . . 40.0 112.781 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.622 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.0 OUTLIER -47.59 -47.23 28.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.583 -0.698 . . . . 40.0 110.135 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.24 -50.91 38.4 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.52 -1.032 . . . . 40.0 110.52 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.2 t -65.58 -46.38 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.097 -1.237 . . . . 40.0 109.426 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.994 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.71 -57.1 13.88 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.417 -0.802 . . . . 40.0 110.246 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.08 -51.36 58.13 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 108.904 -0.776 . . . . 40.0 108.904 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.644 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.0 t80 -51.12 -49.93 59.82 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.969 0.89 . . . . 40.0 109.781 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.607 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 34.7 mt -68.25 -45.5 73.03 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.623 -0.673 . . . . 40.0 110.118 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.4 ' HG3' HD11 ' A' ' 96' ' ' ILE . 24.4 mt-30 -65.27 -19.12 65.82 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.387 -0.925 . . . . 40.0 111.744 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.9 m -107.52 -44.01 4.39 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.766 -1.209 . . . . 40.0 110.821 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.594 ' O ' ' N ' ' A' ' 19' ' ' LYS . 83.9 m-85 -104.52 -14.44 15.67 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 40.0 111.615 -177.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.607 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.3 m-70 59.54 -33.44 0.06 Allowed 'General case' 0 N--CA 1.51 2.549 0 CA-C-O 121.288 0.566 . . . . 40.0 111.483 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.644 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -68.68 120.85 15.32 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.758 -1.214 . . . . 40.0 108.233 179.481 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.541 ' HA ' HD21 ' A' ' 14' ' ' LEU . 3.4 mt -48.13 133.02 12.34 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.335 -0.853 . . . . 40.0 109.398 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.458 ' O ' ' N ' ' A' ' 23' ' ' ASN . 78.7 Cg_exo -35.82 132.36 0.29 Allowed 'Trans proline' 0 C--N 1.313 -1.341 0 C-N-CA 122.732 2.288 . . . . 40.0 112.889 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.557 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.3 OUTLIER -63.48 74.8 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.955 0.883 . . . . 40.0 109.732 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.655 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 172.42 15.68 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.655 -0.653 . . . . 40.0 110.577 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -114.93 162.94 16.26 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.747 0.784 . . . . 40.0 111.095 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -149.38 151.4 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.086 -1.009 . . . . 40.0 109.698 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.477 HG22 ' O ' ' A' ' 53' ' ' GLY . 77.7 p -71.57 149.64 45.48 Favored 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 109.049 -0.723 . . . . 40.0 109.049 177.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.623 ' NZ ' ' OD2' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -48.77 -53.67 18.14 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.196 -1.039 . . . . 40.0 108.196 177.812 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.2 t -45.58 -63.19 1.01 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.739 -0.6 . . . . 40.0 110.415 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.436 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 44.5 mt-10 -49.42 -57.12 7.52 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.54 -0.725 . . . . 40.0 109.357 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.01 -48.49 70.38 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.324 -0.86 . . . . 40.0 109.91 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.408 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 57.0 mt-30 -64.43 -48.74 74.18 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 40.0 110.192 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.18 70.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 40.0 110.46 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.68 -20.35 66.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.288 -0.883 . . . . 40.0 109.209 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.566 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 132.73 -4.04 5.04 Favored Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.942 -1.123 . . . . 40.0 111.106 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -61.2 114.39 3.12 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.709 -1.465 . . . . 40.0 109.098 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.7 t -121.93 143.0 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-O 121.799 0.809 . . . . 40.0 110.626 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.08 -47.58 84.03 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.642 -0.661 . . . . 40.0 110.243 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.2 p -79.13 50.15 1.02 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.064 -1.022 . . . . 40.0 108.997 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -174.25 -51.55 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.115 -0.698 . . . . 40.0 109.115 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.63 23.76 75.4 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.566 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.1 p-10 -56.51 130.11 43.64 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.838 -0.801 . . . . 40.0 108.967 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.663 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.4 tp -168.26 -60.05 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.997 -0.742 . . . . 40.0 108.997 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . . . -56.32 -23.64 38.44 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.312 -0.868 . . . . 40.0 109.808 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -65.06 0.98 Allowed 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.916 -0.772 . . . . 40.0 108.916 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.49 -26.76 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-O 121.468 0.652 . . . . 40.0 109.553 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.517 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -144.65 78.64 12.88 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.32 -0.862 . . . . 40.0 109.873 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 43' ' ' ALA . 20.0 Cg_exo -57.49 52.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.497 1.728 0 C-N-CA 122.847 2.364 . . . . 40.0 114.238 -178.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.34 42.92 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 C-N-CA 119.565 -1.302 . . . . 40.0 111.262 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.517 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 10.6 tttt -121.71 144.5 48.75 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.26 . . . . 40.0 109.996 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.0 m -116.25 132.18 56.74 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.177 -0.952 . . . . 40.0 109.941 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.483 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.8 mm -63.89 150.86 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.342 -0.849 . . . . 40.0 110.099 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 152.77 151.61 5.73 Favored Glycine 0 N--CA 1.502 3.048 0 C-N-CA 119.798 -1.191 . . . . 40.0 110.472 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.477 ' O ' HG22 ' A' ' 26' ' ' THR . . . 118.82 18.2 4.83 Favored Glycine 0 N--CA 1.497 2.709 0 O-C-N 121.177 -1.19 . . . . 40.0 110.865 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.623 ' OD2' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -75.78 -169.93 1.2 Allowed 'General case' 0 C--O 1.191 -1.987 0 O-C-N 121.182 -1.187 . . . . 40.0 109.537 179.768 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.8 mm -133.81 142.1 42.29 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.906 0 CA-C-O 121.726 0.774 . . . . 40.0 109.945 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -154.51 146.85 23.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.696 -0.627 . . . . 40.0 109.53 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.685 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -93.39 -19.38 21.37 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.431 -0.793 . . . . 40.0 110.874 -179.762 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.535 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.8 t30 69.15 30.14 4.45 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.115 -0.99 . . . . 40.0 111.825 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.685 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.86 -31.69 65.07 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.966 -1.084 . . . . 40.0 108.43 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.456 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.0 mp0 -63.47 -11.54 24.51 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 63.24 41.23 99.64 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.153 -1.179 . . . . 40.0 110.153 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.653 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -91.6 -13.81 31.3 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.446 -1.032 . . . . 40.0 109.157 179.706 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.535 ' H ' HD21 ' A' ' 58' ' ' ASN . 30.8 mt -135.72 163.37 51.01 Favored Pre-proline 0 N--CA 1.494 1.762 0 N-CA-C 108.579 -0.897 . . . . 40.0 108.579 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.631 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 85.4 Cg_exo -43.21 140.11 3.72 Favored 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 121.915 1.744 . . . . 40.0 112.239 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.619 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.16 -165.8 11.4 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.819 -1.312 . . . . 40.0 109.819 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.499 ' HB3' ' NH2' ' A' ' 69' ' ' ARG . 1.4 pttm 171.45 -154.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 107.6 -1.259 . . . . 40.0 107.6 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' A' ' 67' ' ' SER . 17.6 p -74.57 81.91 2.0 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.245 -1.391 . . . . 40.0 107.245 176.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.429 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.85 105.19 0.21 Allowed Glycine 0 N--CA 1.499 2.872 0 N-CA-C 108.762 -1.735 . . . . 40.0 108.762 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.621 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -126.53 141.52 51.84 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.654 -0.909 . . . . 40.0 110.155 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.641 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 27.8 p -108.71 130.13 55.36 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.955 -0.757 . . . . 40.0 108.955 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.631 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 33.5 m95 -121.78 146.24 47.25 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 119.522 -0.871 . . . . 40.0 110.895 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.54 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.8 OUTLIER -147.13 140.77 25.65 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.095 -1.003 . . . . 40.0 109.314 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -111.85 164.59 12.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.0 -1.062 . . . . 40.0 111.17 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . . . -151.41 147.12 26.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.693 -0.63 . . . . 40.0 109.62 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.639 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.51 155.8 40.23 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.097 -1.002 . . . . 40.0 110.583 -178.503 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.514 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 17.0 mm -139.19 151.81 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.255 -0.903 . . . . 40.0 110.147 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.566 HD22 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 57.96 53.88 6.49 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.311 0.577 . . . . 40.0 111.096 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.663 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 61.5 t80 -118.32 153.78 33.41 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.314 -0.866 . . . . 40.0 108.997 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.9 p -132.8 -79.09 0.49 Allowed 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.739 0.781 . . . . 40.0 109.765 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.26 101.83 2.72 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 109.387 -0.597 . . . . 40.0 109.387 -178.918 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -104.99 0.27 Allowed Glycine 0 N--CA 1.5 2.913 0 N-CA-C 109.643 -1.383 . . . . 40.0 109.643 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.478 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 23.1 t80 -125.85 -178.0 4.13 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.522 -0.987 . . . . 40.0 109.882 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 3.0 mtm180 -83.55 -152.02 0.12 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.43 -0.793 . . . . 40.0 110.456 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.421 HD21 ' HB2' ' A' ' 86' ' ' ASP . 38.4 p-10 -164.01 -132.58 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.686 -0.857 . . . . 40.0 108.686 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 100' ' ' THR . 15.4 p -116.48 -9.63 11.4 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.199 -0.938 . . . . 40.0 109.575 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.65 ' OD1' HG22 ' A' ' 100' ' ' THR . 12.6 m-20 -75.01 108.99 8.1 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-N 116.4 -0.364 . . . . 40.0 110.758 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.824 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.57 140.14 44.42 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.232 -0.917 . . . . 40.0 110.395 179.393 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.662 ' O ' HD22 ' A' ' 89' ' ' LEU . 11.8 tt -108.57 148.98 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-O 122.533 1.159 . . . . 40.0 110.341 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.662 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.9 mm? -126.94 124.65 39.99 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.431 -0.951 . . . . 40.0 108.431 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.3 p90 -128.36 141.38 51.44 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 108.968 -0.753 . . . . 40.0 108.968 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.573 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 59.4 p -107.51 -178.4 3.62 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.083 -1.01 . . . . 40.0 112.017 -176.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.641 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.58 -55.81 22.54 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.403 1.097 . . . . 40.0 108.34 177.464 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.621 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -64.63 5.28 0.31 Allowed 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 114.419 -1.264 . . . . 40.0 110.388 -179.187 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.469 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 66.3 m95 70.46 14.65 7.36 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.74 -0.6 . . . . 40.0 111.856 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 95' ' ' LEU . 26.8 mt -68.42 127.89 34.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 119.66 -1.9 . . . . 40.0 106.719 177.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.994 HD13 ' HB1' ' A' ' 11' ' ' ALA . 3.0 mt -115.96 134.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 CA-C-O 122.803 1.287 . . . . 40.0 111.602 -177.419 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.429 ' CE1' ' HG2' ' A' ' 64' ' ' PRO . 13.9 m-85 -126.91 157.22 39.98 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.269 -1.382 . . . . 40.0 107.269 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.435 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.3 144.75 50.99 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 118.929 -1.108 . . . . 40.0 112.39 -178.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.425 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.17 132.68 38.28 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.772 -1.195 . . . . 40.0 107.772 177.631 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.65 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.2 p -117.87 9.2 12.82 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-O 120.91 0.386 . . . . 40.0 109.973 -177.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.602 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.99 33.18 5.38 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.768 -0.773 . . . . 40.0 109.973 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 63.17 70.13 0.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.975 -1.078 . . . . 40.0 110.362 178.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 56.49 48.33 16.99 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.52 -0.737 . . . . 40.0 109.835 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.602 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 27.3 mm-40 -120.0 -77.71 0.58 Allowed 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.724 -1.235 . . . . 40.0 109.339 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.557 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 17.7 p -94.78 120.58 35.23 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.724 -1.235 . . . . 40.0 110.155 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.512 ' CD1' ' N ' ' A' ' 106' ' ' PHE . 5.7 m-85 -102.28 86.4 2.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.417 -0.802 . . . . 40.0 110.545 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.4 m -79.13 146.9 32.92 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.199 -0.938 . . . . 40.0 109.036 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.503 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 58.0 tttp -78.04 146.87 35.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.796 -0.565 . . . . 40.0 110.41 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.741 HD11 ' CG2' ' A' ' 96' ' ' ILE . 22.4 pt -128.98 -32.0 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 N-CA-C 109.126 -0.694 . . . . 40.0 109.126 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.622 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 108.493 -0.929 . . . . 40.0 108.493 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.687 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.6 t . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.647 -0.501 . . . . 40.0 109.647 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.531 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -137.88 148.93 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.243 -0.911 . . . . 40.0 109.065 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -149.05 34.03 0.74 Allowed 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.209 -0.932 . . . . 40.0 109.798 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 24.4 p -120.09 142.91 48.45 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 119.635 -0.826 . . . . 40.0 110.56 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.584 ' CE2' HG21 ' A' ' 76' ' ' ILE . 68.8 m-85 -43.28 -84.98 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 CA-C-O 121.952 0.882 . . . . 40.0 112.573 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.629 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.6 OUTLIER -45.82 -47.56 15.8 Favored 'General case' 0 C--N 1.283 -2.298 0 O-C-N 121.853 -0.529 . . . . 40.0 110.035 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.62 -49.92 50.96 Favored Glycine 0 N--CA 1.502 3.048 0 N-CA-C 110.331 -1.108 . . . . 40.0 110.331 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -66.17 -43.97 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.224 -1.162 . . . . 40.0 108.562 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.84 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.86 -58.33 8.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.252 -0.905 . . . . 40.0 109.388 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.05 -49.38 63.58 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.368 0.604 . . . . 40.0 109.605 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.612 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.6 t80 -53.67 -48.96 68.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.011 0.91 . . . . 40.0 109.65 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.578 HD21 ' HA ' ' A' ' 20' ' ' LEU . 29.9 mt -69.63 -46.12 66.93 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.805 -0.559 . . . . 40.0 110.658 -178.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -64.72 -22.11 66.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.429 -0.794 . . . . 40.0 110.875 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 m -103.25 -43.89 5.33 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.643 -1.286 . . . . 40.0 111.851 -178.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.558 ' O ' ' N ' ' A' ' 19' ' ' LYS . 86.2 m-85 -107.51 -12.6 15.26 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.168 -0.957 . . . . 40.0 111.005 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.54 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 60.56 -30.9 0.06 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.975 -0.453 . . . . 40.0 111.817 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.612 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -69.69 117.48 11.34 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.936 -1.103 . . . . 40.0 108.583 179.254 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.578 ' HA ' HD21 ' A' ' 14' ' ' LEU . 3.3 mt -44.92 131.75 5.26 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.476 -0.765 . . . . 40.0 109.151 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.509 ' HD2' HD23 ' A' ' 20' ' ' LEU . 71.3 Cg_exo -34.59 132.72 0.17 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.782 2.321 . . . . 40.0 112.549 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.561 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -63.49 74.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.59 0.709 . . . . 40.0 110.479 -179.313 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.687 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 172.37 18.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.578 -0.701 . . . . 40.0 110.681 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -116.57 160.96 19.9 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.52 -0.738 . . . . 40.0 110.978 -178.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.52 152.58 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.249 -0.907 . . . . 40.0 109.151 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.456 HG22 ' O ' ' A' ' 53' ' ' GLY . 72.9 p -71.5 151.01 44.3 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.367 0.603 . . . . 40.0 110.093 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -50.67 -51.75 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.74 -1.207 . . . . 40.0 107.74 177.251 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.9 t -47.13 -62.13 1.56 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.282 -0.886 . . . . 40.0 110.232 178.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -48.53 -58.67 4.33 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.288 -0.883 . . . . 40.0 109.162 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.26 -49.42 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 121.562 0.696 . . . . 40.0 110.067 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -65.07 -50.09 67.49 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.371 0.605 . . . . 40.0 110.32 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.1 -30.36 70.36 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.434 -0.791 . . . . 40.0 110.16 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.9 mt -68.22 -19.69 64.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 40.0 109.215 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.537 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.85 -2.19 5.18 Favored Glycine 0 N--CA 1.5 2.922 0 C-N-CA 119.847 -1.168 . . . . 40.0 111.221 178.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -62.56 113.79 3.17 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.697 -1.472 . . . . 40.0 109.047 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -121.69 144.91 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 40.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.79 85.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.442 -0.786 . . . . 40.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.2 p -79.18 52.17 1.27 Allowed 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.266 -1.013 . . . . 40.0 108.266 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -174.83 -52.26 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 109.261 -0.644 . . . . 40.0 109.261 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.65 22.94 76.88 Favored Glycine 0 N--CA 1.5 2.954 0 N-CA-C 109.38 -1.488 . . . . 40.0 109.38 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.537 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.0 p-10 -59.78 126.51 27.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.58 -0.953 . . . . 40.0 110.304 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.504 HD11 HD11 ' A' ' 51' ' ' ILE . 0.9 OUTLIER -165.53 -57.59 0.03 OUTLIER 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.552 -0.907 . . . . 40.0 108.552 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.463 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . . . -53.93 -29.14 41.04 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.264 -0.897 . . . . 40.0 109.865 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -63.0 1.37 Allowed 'General case' 0 N--CA 1.504 2.228 0 CA-C-O 121.553 0.692 . . . . 40.0 109.732 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.6 m -71.1 -23.76 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.409 -0.807 . . . . 40.0 110.403 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.606 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.78 76.38 9.75 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.153 -0.967 . . . . 40.0 109.461 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 43' ' ' ALA . 2.8 Cg_exo -61.82 57.28 0.12 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.213 1.942 . . . . 40.0 113.097 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 146.62 36.18 0.06 OUTLIER Glycine 0 N--CA 1.504 3.179 0 N-CA-C 110.71 -0.956 . . . . 40.0 110.71 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.606 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 9.4 tttt -118.48 144.14 46.22 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.724 -1.457 . . . . 40.0 109.995 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.8 m -117.02 134.36 54.85 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.217 -0.927 . . . . 40.0 109.314 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.504 HD11 HD11 ' A' ' 42' ' ' LEU . 8.7 mm -65.01 148.41 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 CA-C-O 121.675 0.75 . . . . 40.0 109.719 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.81 145.34 4.12 Favored Glycine 0 N--CA 1.494 2.529 0 C-N-CA 119.002 -1.57 . . . . 40.0 111.151 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.456 ' O ' HG22 ' A' ' 26' ' ' THR . . . 124.14 17.52 3.0 Favored Glycine 0 N--CA 1.494 2.564 0 C-N-CA 119.986 -1.102 . . . . 40.0 111.11 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.565 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -73.33 -166.58 0.34 Allowed 'General case' 0 C--O 1.196 -1.713 0 O-C-N 120.844 -1.386 . . . . 40.0 109.908 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -134.72 140.48 45.5 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.688 0 CA-C-O 121.555 0.693 . . . . 40.0 109.826 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -152.26 146.35 25.35 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.542 -0.724 . . . . 40.0 109.727 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.679 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.23 -18.37 21.75 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.497 -0.752 . . . . 40.0 110.529 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.603 HD21 ' H ' ' A' ' 63' ' ' LEU . 63.3 t30 69.3 29.04 4.67 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.113 -0.992 . . . . 40.0 111.633 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.679 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.45 -30.83 63.35 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.039 -1.038 . . . . 40.0 108.213 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 24.5 mp0 -64.75 -10.3 26.6 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.369 -0.604 . . . . 40.0 109.369 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.29 44.89 97.03 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.031 -1.228 . . . . 40.0 110.031 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.667 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -94.95 -13.16 25.6 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.603 -0.939 . . . . 40.0 109.249 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.623 HD21 ' CD2' ' A' ' 106' ' ' PHE . 24.3 mt -135.18 164.05 46.63 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 108.378 -0.971 . . . . 40.0 108.378 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.546 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 94.8 Cg_exo -44.08 138.13 6.82 Favored 'Trans proline' 0 N--CA 1.495 1.595 0 C-N-CA 121.83 1.687 . . . . 40.0 112.006 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.608 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.15 -167.4 11.94 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 110.205 -1.158 . . . . 40.0 110.205 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.514 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.2 pttm 173.7 -158.67 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.15 -1.426 . . . . 40.0 107.15 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.46 ' O ' ' OG ' ' A' ' 67' ' ' SER . 32.6 p -73.6 92.29 1.93 Allowed 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.371 -1.344 . . . . 40.0 107.371 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.514 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.1 98.99 0.11 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.116 -1.593 . . . . 40.0 109.116 -178.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.608 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.9 tpp180 -124.49 138.79 54.31 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.7 -0.882 . . . . 40.0 109.587 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.596 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 22.4 p -106.79 130.64 54.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.5 -0.926 . . . . 40.0 108.5 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.573 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 30.6 m95 -122.43 145.49 48.24 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.379 -0.826 . . . . 40.0 110.545 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.552 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.0 OUTLIER -142.95 145.36 32.93 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.289 -0.882 . . . . 40.0 109.583 -179.236 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -114.8 166.44 11.76 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.09 -1.006 . . . . 40.0 111.557 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 88' ' ' ILE . . . -156.02 143.6 19.42 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.275 -0.891 . . . . 40.0 110.371 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.658 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.3 OUTLIER -66.87 153.38 43.62 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.313 -0.867 . . . . 40.0 111.188 -178.79 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.584 HG21 ' CE2' ' A' ' 7' ' ' PHE . 18.7 mm -136.98 153.5 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.393 -0.817 . . . . 40.0 109.799 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.499 HD22 ' CG ' ' A' ' 86' ' ' ASP . 74.8 m-20 56.44 51.62 11.13 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.064 0.459 . . . . 40.0 111.872 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.475 ' CG ' ' N ' ' A' ' 79' ' ' THR . 59.3 t80 -117.39 154.01 32.06 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.126 -0.983 . . . . 40.0 109.323 178.119 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.65 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.4 p -131.97 -79.61 0.51 Allowed 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.058 0.932 . . . . 40.0 109.424 178.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.65 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -150.89 106.0 3.33 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.773 -0.825 . . . . 40.0 108.773 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 150.76 -107.79 0.36 Allowed Glycine 0 N--CA 1.499 2.883 0 N-CA-C 109.803 -1.319 . . . . 40.0 109.803 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.444 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.7 t80 -125.08 -177.97 4.03 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.345 -1.091 . . . . 40.0 109.376 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.444 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -82.6 -151.74 0.1 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.418 -0.801 . . . . 40.0 110.37 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.452 HD21 ' HB2' ' A' ' 77' ' ' ASN . 36.8 p30 -163.92 -134.21 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.253 -1.017 . . . . 40.0 108.253 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 100' ' ' THR . 53.3 p -116.02 -9.05 11.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.891 -1.131 . . . . 40.0 109.621 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.631 ' OD1' HG22 ' A' ' 100' ' ' THR . 19.7 m-20 -74.45 109.53 8.01 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 120.798 0.333 . . . . 40.0 110.414 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.804 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.45 139.9 44.45 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 119.521 -0.872 . . . . 40.0 109.951 179.31 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.649 ' O ' HD22 ' A' ' 89' ' ' LEU . 18.9 tt -108.79 149.1 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-O 122.403 1.096 . . . . 40.0 110.117 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.649 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.9 mm? -125.74 127.21 45.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.355 -0.841 . . . . 40.0 109.026 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.552 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.0 p90 -129.93 140.65 50.9 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.492 -0.558 . . . . 40.0 109.492 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.573 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.5 p -105.4 -178.07 3.55 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-O 122.27 1.033 . . . . 40.0 112.73 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.596 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -56.2 -50.54 70.95 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-O 122.205 1.003 . . . . 40.0 108.645 178.039 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.539 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -70.25 4.95 1.91 Allowed 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 114.656 -1.157 . . . . 40.0 110.234 -178.85 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.513 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 69.7 m95 72.21 17.4 4.99 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.848 -0.532 . . . . 40.0 111.474 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.449 ' HA ' HD23 ' A' ' 95' ' ' LEU . 18.8 mt -72.04 125.83 28.24 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.901 -1.518 . . . . 40.0 106.901 177.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.84 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.4 mp -112.97 133.54 58.48 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 CA-C-O 122.798 1.285 . . . . 40.0 111.975 -177.232 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.577 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 13.3 m-85 -126.14 158.52 35.31 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.402 -1.333 . . . . 40.0 107.402 178.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.4 ' HD2' ' CG2' ' A' ' 109' ' ' ILE . 6.1 ptmm? -126.79 143.75 51.16 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.642 -1.223 . . . . 40.0 112.462 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.421 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.9 129.62 36.63 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.521 -1.289 . . . . 40.0 107.521 177.494 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.631 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.7 p -115.6 9.47 15.34 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 109.718 -0.475 . . . . 40.0 109.718 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.592 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.1 35.18 4.45 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 119.799 -0.76 . . . . 40.0 109.36 179.183 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.2 68.76 0.74 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.383 -0.823 . . . . 40.0 111.168 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 62.07 40.37 12.12 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.47 -0.769 . . . . 40.0 110.657 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.592 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.2 mm-40 -114.39 -76.14 0.58 Allowed 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.749 -1.219 . . . . 40.0 110.002 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.546 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 27.5 p -95.13 124.0 38.93 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.706 -1.246 . . . . 40.0 110.068 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.623 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.7 m-85 -104.44 84.71 2.23 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.475 -0.765 . . . . 40.0 110.891 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.35 145.42 35.26 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.954 -1.091 . . . . 40.0 108.948 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.577 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 59.1 tttp -76.84 143.72 39.54 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.972 -0.455 . . . . 40.0 110.193 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.729 HD11 HG22 ' A' ' 96' ' ' ILE . 36.8 pt -127.45 -31.4 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 109.446 -0.576 . . . . 40.0 109.446 178.266 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.629 HH22 ' CG ' ' A' ' 8' ' ' ASP . 1.4 mmt-85 . . . . . 0 N--CA 1.504 2.241 0 N-CA-C 109.157 -0.683 . . . . 40.0 109.157 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.704 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.1 t . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 121.003 0.43 . . . . 40.0 109.983 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.574 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.0 mt -138.02 148.62 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.288 -0.883 . . . . 40.0 109.824 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -149.24 32.62 0.74 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.265 -0.897 . . . . 40.0 109.515 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 37.9 p -118.65 139.23 51.85 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.782 0.801 . . . . 40.0 110.314 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.507 ' CE2' HG21 ' A' ' 76' ' ' ILE . 55.9 m-85 -40.62 -87.95 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 122.291 1.043 . . . . 40.0 113.367 -178.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.661 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.5 OUTLIER -44.13 -48.78 9.13 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 115.734 -0.666 . . . . 40.0 109.877 -179.042 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.48 -50.49 41.54 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 110.298 -1.121 . . . . 40.0 110.298 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.7 t -65.42 -46.32 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.019 -1.283 . . . . 40.0 109.099 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 1.027 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -55.17 -57.89 9.9 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.573 0.701 . . . . 40.0 110.119 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.21 -49.72 63.34 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.681 -0.637 . . . . 40.0 109.672 178.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.592 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 18.5 t80 -51.65 -50.17 60.87 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.312 1.053 . . . . 40.0 108.605 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.634 HD21 ' HA ' ' A' ' 20' ' ' LEU . 25.6 mt -69.28 -45.12 70.41 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.592 -0.731 . . . . 40.0 111.006 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.402 ' HG3' HD11 ' A' ' 96' ' ' ILE . 16.8 mt-30 -65.08 -21.61 66.84 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 40.0 110.926 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.9 m -103.09 -44.7 5.14 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.015 -1.053 . . . . 40.0 111.56 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.574 ' C ' ' H ' ' A' ' 19' ' ' LYS . 88.9 m-85 -105.53 -13.63 15.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.129 -0.982 . . . . 40.0 111.42 -177.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.573 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 59.77 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 121.303 0.573 . . . . 40.0 111.759 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.592 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.65 117.92 14.93 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 120.494 -1.379 . . . . 40.0 108.886 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.634 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -45.84 128.44 6.89 Favored Pre-proline 0 C--N 1.296 -1.74 0 O-C-N 121.328 -0.858 . . . . 40.0 109.461 -179.571 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.55 ' HD2' HD23 ' A' ' 20' ' ' LEU . 75.1 Cg_exo -34.11 133.31 0.14 Allowed 'Trans proline' 0 N--CA 1.489 1.251 0 C-N-CA 122.976 2.451 . . . . 40.0 112.988 -179.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.575 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -64.78 75.75 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.806 0.812 . . . . 40.0 110.791 -178.827 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.704 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 171.83 16.05 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.862 -0.523 . . . . 40.0 110.919 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.498 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 13.4 m-85 -113.06 167.42 10.54 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.432 -0.793 . . . . 40.0 111.353 -179.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -158.16 150.89 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.067 -1.021 . . . . 40.0 108.801 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.3 p -69.7 154.23 42.27 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.384 0.611 . . . . 40.0 109.548 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.643 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -53.29 -50.72 64.3 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.148 -1.427 . . . . 40.0 107.148 176.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -47.65 -62.13 1.6 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.51 -0.744 . . . . 40.0 110.544 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -49.05 -57.61 6.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.347 -0.845 . . . . 40.0 109.172 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.9 -49.99 61.92 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.581 -0.699 . . . . 40.0 109.71 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.405 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 51.4 mt-30 -64.05 -50.07 69.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.689 -0.632 . . . . 40.0 110.762 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.89 -32.79 74.28 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.429 -0.794 . . . . 40.0 109.953 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mt -64.89 -20.68 66.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.268 -0.895 . . . . 40.0 109.334 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.548 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.49 -2.02 5.31 Favored Glycine 0 N--CA 1.498 2.767 0 N-CA-C 110.668 -0.973 . . . . 40.0 110.668 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -59.97 114.01 2.6 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.73 -1.453 . . . . 40.0 109.299 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.27 143.44 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 CA-C-O 121.926 0.869 . . . . 40.0 111.168 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.3 78.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.797 -0.564 . . . . 40.0 110.392 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.5 p -79.32 52.08 1.3 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.016 -1.053 . . . . 40.0 108.452 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -175.49 -52.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.095 -0.706 . . . . 40.0 109.095 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.22 18.14 76.43 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.548 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -52.96 130.35 33.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.943 -0.739 . . . . 40.0 109.905 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.637 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 3.7 tp -169.34 -57.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.517 -0.92 . . . . 40.0 108.517 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.68 -25.36 53.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.231 -0.918 . . . . 40.0 109.934 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.87 -60.05 2.53 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.122 -0.695 . . . . 40.0 109.122 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.2 m -74.27 -22.46 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.527 -0.733 . . . . 40.0 109.64 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.613 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.77 78.78 8.88 Favored Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 40.0 109.339 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -56.24 50.55 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 123.311 2.674 . . . . 40.0 113.998 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.547 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.17 0.06 OUTLIER Glycine 0 N--CA 1.504 3.175 0 C-N-CA 119.911 -1.138 . . . . 40.0 111.047 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.613 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 18.6 tttt -120.14 145.59 46.79 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 120.906 -1.349 . . . . 40.0 109.662 179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 14.8 m -116.61 136.3 53.09 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.306 -0.871 . . . . 40.0 109.642 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.508 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.9 mm -69.63 153.79 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.866 . . . . 40.0 110.223 -179.044 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.77 143.98 3.83 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 119.048 -1.548 . . . . 40.0 110.401 179.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 128.88 13.2 2.5 Favored Glycine 0 N--CA 1.496 2.636 0 C-N-CA 119.495 -1.336 . . . . 40.0 111.217 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.617 ' CG ' ' HZ1' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -73.99 -172.83 1.43 Allowed 'General case' 0 C--O 1.195 -1.804 0 O-C-N 120.904 -1.35 . . . . 40.0 110.84 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.48 143.74 40.06 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 CA-C-O 121.701 0.762 . . . . 40.0 110.173 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -155.94 147.2 22.53 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.31 -0.868 . . . . 40.0 109.54 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.717 ' HG ' HH12 ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.19 -16.6 24.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.739 -0.601 . . . . 40.0 110.636 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.9 t30 66.19 28.09 10.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.17 -0.956 . . . . 40.0 111.72 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.717 HH12 ' HG ' ' A' ' 57' ' ' SER . 1.1 mtm-85 -56.45 -31.06 63.62 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.023 -1.048 . . . . 40.0 108.384 178.304 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.488 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 17.4 mp0 -61.93 -12.1 16.46 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.903 -0.777 . . . . 40.0 108.903 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.55 40.44 99.13 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 110.003 -1.239 . . . . 40.0 110.003 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.581 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -93.99 -10.51 33.37 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.828 -0.807 . . . . 40.0 109.23 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.521 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 36.9 mt -135.62 162.64 55.92 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 108.032 -1.099 . . . . 40.0 108.032 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.647 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 97.3 Cg_exo -44.79 139.52 7.54 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 121.536 1.491 . . . . 40.0 112.298 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.497 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.94 -169.58 12.49 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 110.361 -1.096 . . . . 40.0 110.361 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.472 ' HB3' ' NH2' ' A' ' 69' ' ' ARG . 3.4 pttm 175.35 -156.66 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.924 -1.51 . . . . 40.0 106.924 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.428 ' O ' ' OG ' ' A' ' 67' ' ' SER . 59.5 p -74.41 84.54 1.97 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.546 -1.279 . . . . 40.0 107.546 178.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.42 102.82 0.2 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 108.417 -1.873 . . . . 40.0 108.417 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.566 HH11 ' CG ' ' A' ' 93' ' ' ASP . 15.6 tpp180 -125.51 141.55 51.98 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.869 -0.783 . . . . 40.0 109.55 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.624 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 25.5 p -108.88 131.31 55.13 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.741 -0.837 . . . . 40.0 108.741 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.647 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.2 m95 -121.91 147.97 45.34 Favored 'General case' 0 N--CA 1.5 2.047 0 C-N-CA 119.453 -0.899 . . . . 40.0 111.014 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.589 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.3 mpp_? -146.02 144.72 30.26 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.183 -0.948 . . . . 40.0 109.676 -178.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.643 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.09 165.55 13.01 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.146 -0.971 . . . . 40.0 111.515 179.558 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.498 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -152.16 147.5 26.5 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.504 -0.748 . . . . 40.0 109.574 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.685 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -71.38 150.77 44.71 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.592 -0.693 . . . . 40.0 110.244 -179.061 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.507 HG21 ' CE2' ' A' ' 7' ' ' PHE . 15.5 mm -134.66 150.59 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 40.0 109.916 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.528 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.7 m-20 58.26 60.15 2.76 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-O 121.235 0.541 . . . . 40.0 111.485 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.637 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 66.2 t80 -123.87 154.28 39.89 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.103 -0.998 . . . . 40.0 109.385 178.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.602 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.0 p -132.19 -80.38 0.5 Allowed 'General case' 0 N--CA 1.502 2.154 0 CA-C-O 121.719 0.771 . . . . 40.0 110.005 179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.602 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.16 102.01 2.75 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 109.167 -0.679 . . . . 40.0 109.167 -179.107 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.88 -104.32 0.26 Allowed Glycine 0 N--CA 1.5 2.965 0 N-CA-C 109.833 -1.307 . . . . 40.0 109.833 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.451 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.8 t80 -125.79 -178.42 4.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.47 -1.018 . . . . 40.0 109.934 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.456 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.7 mtm180 -83.86 -151.88 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.655 -0.653 . . . . 40.0 110.425 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.511 HD21 ' HB2' ' A' ' 86' ' ' ASP . 47.7 p-10 -164.7 -136.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.851 -0.796 . . . . 40.0 108.851 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.459 ' OG ' ' O ' ' A' ' 100' ' ' THR . 22.4 p -113.13 -11.85 13.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.993 -1.067 . . . . 40.0 109.871 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.572 ' OD1' HG22 ' A' ' 100' ' ' THR . 11.8 m-20 -71.79 109.17 5.49 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 120.964 0.412 . . . . 40.0 110.518 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.831 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.85 140.55 44.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.533 -0.729 . . . . 40.0 110.025 179.657 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.695 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.9 tt -111.23 149.93 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 CA-C-O 122.375 1.084 . . . . 40.0 109.757 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.695 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -127.18 127.54 44.67 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 109.326 -0.62 . . . . 40.0 109.326 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.589 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.6 p90 -131.65 141.76 49.69 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 109.116 -0.698 . . . . 40.0 109.116 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.536 ' HB3' ' CE2' ' A' ' 71' ' ' TRP . 64.3 p -107.61 -179.86 4.03 Favored 'General case' 0 N--CA 1.505 2.287 0 CA-C-O 122.22 1.01 . . . . 40.0 112.418 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.624 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.77 -50.54 63.34 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 122.35 1.072 . . . . 40.0 108.636 178.508 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.566 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 3.83 1.84 Allowed 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.598 -1.183 . . . . 40.0 110.241 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.535 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 78.5 m95 72.53 13.59 5.36 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.764 -0.585 . . . . 40.0 111.758 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.494 ' HA ' HD23 ' A' ' 95' ' ' LEU . 21.1 mt -70.01 128.9 37.94 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.819 -1.8 . . . . 40.0 107.562 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 1.027 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mt -114.59 135.54 54.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 CA-C-O 122.707 1.241 . . . . 40.0 112.527 -176.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.559 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.8 m-85 -127.75 156.49 42.35 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.377 -1.342 . . . . 40.0 107.377 179.057 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.464 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 4.7 ptmm? -125.31 143.64 50.87 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 118.758 -1.177 . . . . 40.0 112.73 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.408 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -134.84 132.09 38.19 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.233 -1.395 . . . . 40.0 107.233 177.722 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.572 HG22 ' OD1' ' A' ' 86' ' ' ASP . 4.0 p -117.9 11.56 13.51 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 109.566 -0.531 . . . . 40.0 109.566 -177.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.604 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -116.32 32.97 5.8 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.902 -0.719 . . . . 40.0 109.798 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 64.37 66.62 0.61 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.012 -1.055 . . . . 40.0 111.03 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 60.76 43.2 12.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.266 -0.896 . . . . 40.0 110.472 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.604 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.6 mm-40 -116.37 -76.81 0.57 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.621 -1.299 . . . . 40.0 109.104 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.544 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.9 p -94.25 122.27 36.61 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.67 -1.269 . . . . 40.0 109.785 -178.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.55 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 4.9 m-85 -104.11 84.73 2.27 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.54 -0.725 . . . . 40.0 110.972 -179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 m -77.9 144.51 36.84 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.916 -1.115 . . . . 40.0 109.314 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.572 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 60.5 tttp -75.83 147.72 38.93 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.41 -0.806 . . . . 40.0 110.592 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.81 HD11 HG22 ' A' ' 96' ' ' ILE . 38.8 pt -129.81 -31.14 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 109.223 -0.658 . . . . 40.0 109.223 178.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.661 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.15 0 CA-C-O 118.514 -0.755 . . . . 40.0 109.097 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.678 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 109.917 -0.401 . . . . 40.0 109.917 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.582 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.7 mt -140.13 147.79 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 40.0 109.068 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -149.98 35.03 0.67 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.072 -1.017 . . . . 40.0 109.454 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.6 p -119.76 144.07 47.47 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 119.577 -0.849 . . . . 40.0 110.512 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.507 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 62.0 m-85 -45.23 -85.56 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 N-CA-C 113.471 0.915 . . . . 40.0 113.471 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.642 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.14 -46.26 17.08 Favored 'General case' 0 C--N 1.288 -2.071 0 O-C-N 121.623 -0.673 . . . . 40.0 110.117 -179.294 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.03 60.45 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.732 -0.947 . . . . 40.0 110.732 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.6 t -66.84 -42.11 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.019 -1.283 . . . . 40.0 108.29 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.909 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -60.51 -55.4 33.88 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.961 -1.087 . . . . 40.0 109.585 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.23 -50.24 62.37 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.478 -0.764 . . . . 40.0 109.186 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.607 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 19.2 t80 -52.78 -49.54 65.37 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.72 0.772 . . . . 40.0 109.81 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.647 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.6 mt -68.6 -45.8 71.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.596 -0.69 . . . . 40.0 109.855 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -64.05 -23.02 67.17 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.6 -1.24 . . . . 40.0 110.625 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.2 m -105.41 -41.76 5.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.66 -1.275 . . . . 40.0 111.66 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.601 ' O ' ' N ' ' A' ' 19' ' ' LYS . 79.2 m-85 -103.46 -16.08 15.69 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.762 -1.211 . . . . 40.0 110.846 -177.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.647 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.45 -36.64 0.11 Allowed 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 121.546 0.688 . . . . 40.0 110.662 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.607 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -66.86 118.72 10.75 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 120.83 -1.168 . . . . 40.0 108.265 179.06 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.503 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -45.51 132.93 6.19 Favored Pre-proline 0 N--CA 1.499 2.02 0 O-C-N 121.366 -0.834 . . . . 40.0 108.923 -179.222 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.479 ' O ' ' N ' ' A' ' 23' ' ' ASN . 62.6 Cg_exo -35.31 134.14 0.2 Allowed 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 122.246 1.964 . . . . 40.0 112.557 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.75 73.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.695 0.759 . . . . 40.0 110.067 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.678 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.0 p-10 174.05 19.23 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.763 -0.585 . . . . 40.0 111.197 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.515 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 13.4 m-85 -118.04 162.04 18.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.489 0.662 . . . . 40.0 111.542 -178.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -150.64 152.43 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.275 -0.891 . . . . 40.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 53' ' ' GLY . 76.2 p -72.4 151.7 42.46 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.532 -0.73 . . . . 40.0 109.407 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.646 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -48.7 -53.66 17.94 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.121 -1.066 . . . . 40.0 108.121 177.517 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.5 t -46.19 -63.42 0.99 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.547 -0.721 . . . . 40.0 110.312 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -48.27 -58.4 4.61 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.202 -0.937 . . . . 40.0 108.962 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.72 -49.41 62.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.353 -0.842 . . . . 40.0 110.228 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.441 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 55.6 mt-30 -64.99 -48.97 72.07 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.44 -0.787 . . . . 40.0 110.255 -178.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.28 -31.85 72.9 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.576 -0.703 . . . . 40.0 110.985 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mt -67.68 -19.3 65.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.498 -0.751 . . . . 40.0 109.075 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.5 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.14 0.4 5.1 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 119.945 -1.121 . . . . 40.0 111.358 178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -62.61 114.08 3.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.595 -1.532 . . . . 40.0 108.603 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.3 t -122.11 140.92 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.548 0 CA-C-O 121.891 0.853 . . . . 40.0 110.377 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.51 -47.02 85.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.44 -0.787 . . . . 40.0 109.886 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.6 p -77.74 50.42 0.84 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.886 -1.134 . . . . 40.0 109.063 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -175.79 -48.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.137 0.494 . . . . 40.0 109.767 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.5 72.76 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 108.912 -1.675 . . . . 40.0 108.912 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.5 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.3 p-10 -56.04 130.76 45.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.798 -0.825 . . . . 40.0 109.326 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.602 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.0 tp -170.1 -58.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.66 -0.867 . . . . 40.0 108.66 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.54 -25.48 52.09 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.388 -0.82 . . . . 40.0 109.673 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.435 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -75.63 -65.22 0.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.0 -0.741 . . . . 40.0 109.0 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.2 m -67.14 -29.83 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.428 -0.795 . . . . 40.0 109.753 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -140.46 77.71 23.19 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.746 -0.596 . . . . 40.0 110.227 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.83 50.02 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 123.276 2.65 . . . . 40.0 113.829 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.18 43.83 0.04 OUTLIER Glycine 0 N--CA 1.497 2.733 0 C-N-CA 119.556 -1.307 . . . . 40.0 111.375 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.556 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 10.2 tttt -121.75 145.04 48.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.874 -1.368 . . . . 40.0 109.436 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 m -119.26 133.74 55.59 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.797 -1.189 . . . . 40.0 110.455 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.8 mm -65.49 153.48 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.19 -0.944 . . . . 40.0 110.216 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.502 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.37 145.63 4.17 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.525 -1.43 . . . . 40.0 109.525 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.427 ' O ' HG22 ' A' ' 26' ' ' THR . . . 125.42 15.4 3.03 Favored Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.877 -1.154 . . . . 40.0 111.181 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.533 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -74.81 -166.86 0.5 Allowed 'General case' 0 C--O 1.194 -1.863 0 O-C-N 120.576 -1.544 . . . . 40.0 110.332 -179.077 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.5 mm -134.54 139.57 47.52 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.706 0 CA-C-O 121.6 0.714 . . . . 40.0 109.581 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -151.62 146.99 26.22 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.894 -0.78 . . . . 40.0 108.894 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.683 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -94.16 -18.06 22.12 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 40.0 109.672 -179.186 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.496 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.6 t30 68.71 30.24 4.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.359 -0.838 . . . . 40.0 111.917 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.683 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 0.9 OUTLIER -57.92 -29.98 65.55 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.904 -1.122 . . . . 40.0 108.134 178.534 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 20.9 mp0 -64.35 -11.38 31.83 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.324 0.583 . . . . 40.0 109.462 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.2 44.5 98.04 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 110.339 -1.104 . . . . 40.0 110.339 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.599 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.48 -12.74 25.36 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.566 -0.961 . . . . 40.0 108.828 179.849 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.671 HD21 ' CD2' ' A' ' 106' ' ' PHE . 52.3 mt -136.8 162.17 57.49 Favored Pre-proline 0 N--CA 1.497 1.912 0 N-CA-C 108.318 -0.993 . . . . 40.0 108.318 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.492 ' O ' ' NE1' ' A' ' 71' ' ' TRP . 86.6 Cg_exo -43.75 142.36 3.47 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 122.103 1.869 . . . . 40.0 112.667 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.624 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.77 -165.94 11.35 Favored Glycine 0 N--CA 1.492 2.429 0 C-N-CA 120.018 -1.087 . . . . 40.0 110.915 -178.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.471 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.3 pttm 173.5 -157.79 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 107.775 -1.194 . . . . 40.0 107.775 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.481 ' O ' ' OG ' ' A' ' 67' ' ' SER . 51.6 p -73.54 86.23 1.57 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 106.983 -1.488 . . . . 40.0 106.983 177.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.471 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.91 99.59 0.23 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.295 -1.522 . . . . 40.0 109.295 -178.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.624 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 18.5 tpp180 -121.85 140.84 51.89 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.388 -1.066 . . . . 40.0 110.031 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.6 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 24.8 p -109.4 130.83 55.48 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 108.123 -1.066 . . . . 40.0 108.123 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.503 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 33.8 m95 -121.82 143.69 49.26 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.324 -0.86 . . . . 40.0 111.16 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.579 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.1 mpp_? -141.61 147.5 37.73 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.453 -0.779 . . . . 40.0 109.692 -178.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.646 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -119.24 169.82 9.64 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 119.551 -0.86 . . . . 40.0 112.058 179.897 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.515 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -157.34 145.27 19.05 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.521 -0.737 . . . . 40.0 110.272 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.642 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -69.36 151.93 45.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.667 -0.645 . . . . 40.0 110.292 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.507 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 14.5 mm -135.95 152.65 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.178 -0.951 . . . . 40.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.532 HD22 ' CG ' ' A' ' 86' ' ' ASP . 75.1 m-20 57.94 51.15 9.3 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.01 0.433 . . . . 40.0 111.507 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.602 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 57.1 t80 -116.85 153.13 33.05 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.972 -1.08 . . . . 40.0 109.217 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.604 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.7 p -132.8 -77.55 0.49 Allowed 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.854 0.835 . . . . 40.0 109.608 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.604 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.58 102.28 2.71 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 109.442 -0.577 . . . . 40.0 109.442 -179.392 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 153.09 -104.27 0.25 Allowed Glycine 0 N--CA 1.499 2.874 0 N-CA-C 109.841 -1.304 . . . . 40.0 109.841 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 11.8 t80 -126.03 -179.41 4.69 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.681 -0.894 . . . . 40.0 109.91 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.46 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.3 mtm180 -80.96 -150.87 0.08 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 121.581 0.705 . . . . 40.0 110.049 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.461 HD21 ' HB2' ' A' ' 77' ' ' ASN . 27.3 p30 -164.3 -136.62 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.182 -1.044 . . . . 40.0 108.182 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.467 ' OG ' ' O ' ' A' ' 100' ' ' THR . 50.6 p -114.04 -9.12 13.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.808 -1.183 . . . . 40.0 109.192 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.665 ' OD1' HG22 ' A' ' 100' ' ' THR . 18.3 m-20 -73.69 109.36 7.14 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.287 -0.415 . . . . 40.0 110.394 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.83 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.12 137.25 40.81 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.369 -0.832 . . . . 40.0 110.258 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.544 ' O ' HD22 ' A' ' 89' ' ' LEU . 15.2 tt -108.39 145.88 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 122.61 1.195 . . . . 40.0 110.592 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.0 mm? -123.1 127.23 48.44 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.841 -0.8 . . . . 40.0 108.841 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.579 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.0 p90 -132.05 140.72 48.98 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.746 -0.835 . . . . 40.0 108.746 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.503 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.6 p -107.23 178.46 4.54 Favored 'General case' 0 N--CA 1.51 2.56 0 CA-C-O 122.511 1.148 . . . . 40.0 112.662 -176.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.6 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -49.77 -54.97 15.84 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.569 1.176 . . . . 40.0 108.353 177.164 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.624 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -67.75 6.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.51 -1.223 . . . . 40.0 111.098 -178.848 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.452 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 67.4 m95 70.76 15.22 6.97 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.807 -0.558 . . . . 40.0 112.172 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.9 mt -70.37 127.14 31.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.169 -1.582 . . . . 40.0 106.819 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.909 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.3 mp -113.92 135.21 54.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-O 123.004 1.383 . . . . 40.0 112.224 -177.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.628 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.0 m-85 -128.43 158.17 39.06 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.577 -1.268 . . . . 40.0 107.577 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.448 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.9 ptmm? -126.69 145.97 50.38 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.714 -1.195 . . . . 40.0 112.566 -178.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.423 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.93 130.58 33.94 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.282 -1.377 . . . . 40.0 107.282 177.31 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.665 HG22 ' OD1' ' A' ' 86' ' ' ASP . 2.4 p -116.13 11.07 15.14 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.234 -0.654 . . . . 40.0 109.234 -177.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.589 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -117.29 34.71 4.99 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.723 -0.791 . . . . 40.0 109.498 178.891 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.8 68.33 0.7 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.431 -0.793 . . . . 40.0 111.02 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 60.1 43.85 13.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.429 -0.795 . . . . 40.0 110.279 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.589 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 28.7 mm-40 -116.47 -77.89 0.57 Allowed 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.833 -1.167 . . . . 40.0 108.66 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.514 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.4 p -94.25 120.21 34.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.737 -1.227 . . . . 40.0 110.642 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.671 ' CD2' HD21 ' A' ' 63' ' ' LEU . 10.0 m-85 -101.01 82.73 2.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.342 -0.848 . . . . 40.0 111.589 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.2 m -75.54 142.1 42.86 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.038 -1.038 . . . . 40.0 109.372 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.628 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 61.4 tttp -76.45 148.87 36.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.539 -0.726 . . . . 40.0 110.452 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.678 HD11 HG22 ' A' ' 96' ' ' ILE . 32.7 pt -131.4 -30.13 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 109.144 -0.687 . . . . 40.0 109.144 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.642 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.903 0 CA-C-O 118.394 -0.812 . . . . 40.0 109.088 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.684 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.5 t . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.176 -0.676 . . . . 40.0 109.176 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.563 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.05 150.34 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.468 -0.77 . . . . 40.0 108.992 -179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -150.06 35.15 0.66 Allowed 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.159 -0.963 . . . . 40.0 109.397 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.4 p -119.27 141.58 48.83 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.924 -0.71 . . . . 40.0 110.331 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.489 ' CE2' HG21 ' A' ' 76' ' ' ILE . 69.7 m-85 -43.54 -84.39 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.024 0.916 . . . . 40.0 112.904 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.6 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.97 -47.09 21.92 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 121.724 -0.61 . . . . 40.0 110.08 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.05 -48.53 62.66 Favored Glycine 0 N--CA 1.502 3.046 0 N-CA-C 110.497 -1.041 . . . . 40.0 110.497 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -44.11 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.4 . . . . 40.0 108.452 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.724 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -57.81 -58.04 10.11 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.607 -0.683 . . . . 40.0 110.12 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -51.11 61.35 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.693 -0.855 . . . . 40.0 108.693 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.616 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.9 t80 -50.35 -50.21 51.78 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.931 0.872 . . . . 40.0 109.671 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.614 HD21 ' HA ' ' A' ' 20' ' ' LEU . 24.4 mt -69.69 -45.17 68.9 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.543 -0.723 . . . . 40.0 110.481 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -63.53 -20.89 66.0 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 119.411 -0.915 . . . . 40.0 111.417 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.1 m -105.73 -45.02 4.51 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.692 -1.255 . . . . 40.0 111.463 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.573 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.6 m-85 -102.9 -15.07 16.29 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.351 -0.843 . . . . 40.0 110.913 -177.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.561 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-70 60.6 -30.5 0.06 Allowed 'General case' 0 N--CA 1.505 2.322 0 CA-C-O 121.447 0.641 . . . . 40.0 111.045 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.616 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -69.72 117.99 12.02 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.695 -1.253 . . . . 40.0 108.792 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.614 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -46.5 132.17 7.98 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.47 -0.769 . . . . 40.0 109.427 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.476 ' HD2' HD23 ' A' ' 20' ' ' LEU . 67.7 Cg_exo -36.59 133.66 0.35 Allowed 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.866 2.377 . . . . 40.0 112.5 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.566 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -64.67 75.62 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.011 0.91 . . . . 40.0 110.433 -179.174 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.684 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 174.0 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.733 -0.605 . . . . 40.0 110.406 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 50' ' ' SER . 18.1 m-85 -114.52 163.96 14.65 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.426 -0.796 . . . . 40.0 111.396 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.98 152.06 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.45 -0.781 . . . . 40.0 109.417 178.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 53' ' ' GLY . 61.2 p -72.39 150.75 43.13 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 108.909 -0.774 . . . . 40.0 108.909 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.632 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -49.98 -52.19 35.67 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.529 -0.915 . . . . 40.0 108.529 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -46.74 -61.58 1.78 Allowed 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.446 -0.784 . . . . 40.0 110.268 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.413 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 41.8 mt-10 -50.76 -56.64 11.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.153 -0.967 . . . . 40.0 109.234 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.97 -49.02 66.96 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.459 -0.776 . . . . 40.0 109.739 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.4 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 50.2 mt-30 -65.65 -49.22 69.43 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.751 -0.593 . . . . 40.0 110.291 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.68 -31.04 70.74 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.399 -0.813 . . . . 40.0 110.351 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.38 -18.85 65.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.134 -0.979 . . . . 40.0 109.267 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.562 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 133.04 -4.2 4.95 Favored Glycine 0 N--CA 1.497 2.719 0 C-N-CA 119.871 -1.157 . . . . 40.0 111.087 178.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -62.02 116.04 4.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.544 -1.562 . . . . 40.0 108.746 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 31.0 t -124.12 142.6 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 121.87 0.843 . . . . 40.0 110.506 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.06 83.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.353 -0.842 . . . . 40.0 110.561 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 p -77.68 48.17 0.66 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.825 -1.172 . . . . 40.0 109.318 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -173.58 -50.3 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.572 -0.705 . . . . 40.0 109.328 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.18 24.59 76.5 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 108.974 -1.651 . . . . 40.0 108.974 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.562 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -58.77 130.83 48.8 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.748 -0.854 . . . . 40.0 109.42 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.526 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.2 tp -170.77 -56.69 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.295 -1.002 . . . . 40.0 108.295 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.09 -23.27 32.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 40.0 109.906 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.79 -66.28 0.88 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.899 -0.778 . . . . 40.0 108.899 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 24.5 m -67.32 -26.98 37.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 109.079 -0.712 . . . . 40.0 109.079 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.661 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -142.5 77.97 16.77 Favored Pre-proline 0 N--CA 1.488 1.443 0 O-C-N 121.411 -0.806 . . . . 40.0 109.982 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.95 50.01 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.972 2.448 . . . . 40.0 113.966 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.44 42.22 0.05 OUTLIER Glycine 0 N--CA 1.5 2.942 0 C-N-CA 119.766 -1.207 . . . . 40.0 111.338 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.661 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 13.4 tttt -119.83 147.69 44.36 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.906 -1.349 . . . . 40.0 110.035 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.458 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 13.1 m -117.6 134.1 55.24 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.155 -0.965 . . . . 40.0 109.994 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.482 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.3 mm -67.47 154.89 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.921 -1.112 . . . . 40.0 110.589 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.444 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.63 150.62 5.29 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.491 -1.338 . . . . 40.0 110.049 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.434 ' O ' HG22 ' A' ' 26' ' ' THR . . . 122.34 17.04 3.7 Favored Glycine 0 N--CA 1.494 2.561 0 O-C-N 121.213 -1.169 . . . . 40.0 110.739 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.549 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -75.64 -167.65 0.72 Allowed 'General case' 0 C--O 1.198 -1.628 0 O-C-N 120.989 -1.301 . . . . 40.0 110.426 -179.345 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.8 mm -134.46 141.56 43.13 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.542 0 CA-C-O 121.506 0.669 . . . . 40.0 110.239 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -153.46 145.91 24.06 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.173 -0.954 . . . . 40.0 110.033 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.68 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -92.24 -17.54 24.67 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.444 -0.785 . . . . 40.0 110.14 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.493 HD21 ' H ' ' A' ' 63' ' ' LEU . 66.5 t30 67.21 32.9 5.79 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.06 -1.025 . . . . 40.0 111.419 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.68 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 0.8 OUTLIER -60.84 -29.32 69.43 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.981 -1.074 . . . . 40.0 108.439 178.529 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.437 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 23.8 mp0 -64.63 -13.91 55.72 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.526 -0.546 . . . . 40.0 109.526 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.25 42.69 94.05 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 109.683 -1.367 . . . . 40.0 109.683 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.619 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.57 -10.27 30.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.647 -0.914 . . . . 40.0 109.197 -179.592 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.554 HD21 ' CD2' ' A' ' 106' ' ' PHE . 30.7 mt -138.94 164.05 42.12 Favored Pre-proline 0 N--CA 1.492 1.659 0 N-CA-C 108.535 -0.913 . . . . 40.0 108.535 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.602 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 87.0 Cg_exo -45.16 139.91 8.16 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.025 1.817 . . . . 40.0 111.659 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.643 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.04 -166.29 11.69 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 110.392 -1.083 . . . . 40.0 110.392 -178.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.555 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 pttm 173.33 -158.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 107.859 -1.163 . . . . 40.0 107.859 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' A' ' 67' ' ' SER . 24.2 p -73.64 85.42 1.6 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.165 -1.42 . . . . 40.0 107.165 177.364 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.555 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 79.72 99.94 0.28 Allowed Glycine 0 N--CA 1.496 2.679 0 N-CA-C 108.863 -1.695 . . . . 40.0 108.863 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.643 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 16.9 tpp180 -123.45 140.89 52.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.535 -0.979 . . . . 40.0 110.508 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.612 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 29.5 p -108.83 130.25 55.4 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.632 -0.877 . . . . 40.0 108.632 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.602 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 30.7 m95 -121.48 146.85 46.49 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.343 -0.848 . . . . 40.0 110.381 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.649 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.9 OUTLIER -145.89 146.88 31.26 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.538 -0.726 . . . . 40.0 109.624 -179.21 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.632 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.3 170.72 8.32 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.177 -1.009 . . . . 40.0 112.352 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.445 ' O ' HG22 ' A' ' 88' ' ' ILE . . . -157.36 145.41 19.13 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.487 -0.758 . . . . 40.0 109.981 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.669 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -70.44 153.25 43.16 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.551 -0.718 . . . . 40.0 110.408 -179.206 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.489 HG21 ' CE2' ' A' ' 7' ' ' PHE . 17.8 mm -137.61 153.37 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 40.0 110.088 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.489 HD22 ' CG ' ' A' ' 86' ' ' ASP . 73.8 m-20 55.07 58.49 4.69 Favored 'General case' 0 N--CA 1.5 2.033 0 CA-C-O 121.186 0.517 . . . . 40.0 111.267 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.526 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 56.1 t80 -121.83 155.2 35.87 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 40.0 108.739 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.576 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.8 p -132.32 -79.91 0.5 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 121.672 0.749 . . . . 40.0 109.84 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.576 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.27 101.67 2.86 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.88 -0.785 . . . . 40.0 108.88 -179.284 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.14 -109.09 0.4 Allowed Glycine 0 N--CA 1.5 2.952 0 C-N-CA 119.753 -1.213 . . . . 40.0 110.108 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.445 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.5 t80 -119.42 -177.97 3.49 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.358 -1.084 . . . . 40.0 110.06 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.445 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 4.2 mtm180 -84.47 -150.33 0.12 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.463 -0.773 . . . . 40.0 110.561 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.406 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.7 p30 -164.98 -135.93 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.743 -0.836 . . . . 40.0 108.743 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 100' ' ' THR . 45.6 p -114.21 -10.25 12.77 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.835 -1.166 . . . . 40.0 109.417 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.606 ' OD1' HG22 ' A' ' 100' ' ' THR . 15.5 m-20 -73.04 106.43 4.91 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.95 0.405 . . . . 40.0 110.131 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.858 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -134.05 139.27 45.88 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 119.585 -0.846 . . . . 40.0 110.172 179.768 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.639 ' O ' HD22 ' A' ' 89' ' ' LEU . 18.1 tt -110.12 148.78 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-O 122.064 0.935 . . . . 40.0 110.56 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.639 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.0 mm? -125.21 128.5 48.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.582 -0.699 . . . . 40.0 109.393 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.649 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.4 p90 -131.07 141.71 50.21 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 109.043 -0.725 . . . . 40.0 109.043 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.549 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 60.0 p -107.28 -179.11 3.83 Favored 'General case' 0 N--CA 1.504 2.252 0 CA-C-O 122.162 0.982 . . . . 40.0 112.209 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.612 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -54.55 -53.6 52.33 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.324 1.059 . . . . 40.0 108.794 177.735 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.58 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -65.9 2.2 1.14 Allowed 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 114.643 -1.162 . . . . 40.0 109.975 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 78.5 m95 73.56 16.85 3.88 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 122.017 -0.427 . . . . 40.0 111.652 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 95' ' ' LEU . 24.4 mt -70.52 126.56 29.97 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 106.79 -1.559 . . . . 40.0 106.79 177.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.821 HG22 HD11 ' A' ' 109' ' ' ILE . 2.7 mp -114.26 134.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 122.706 1.241 . . . . 40.0 112.013 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.524 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 10.3 m-85 -127.68 158.88 36.4 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.95 -1.13 . . . . 40.0 107.95 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.435 ' HB3' HD13 ' A' ' 109' ' ' ILE . 5.4 ptmm? -127.13 145.79 50.62 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 118.634 -1.226 . . . . 40.0 112.291 -178.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.454 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.97 129.81 32.69 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 106.897 -1.52 . . . . 40.0 106.897 177.433 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.606 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.4 p -115.98 9.93 15.0 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 109.585 -0.524 . . . . 40.0 109.585 -177.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.594 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.2 34.21 5.0 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.821 -0.751 . . . . 40.0 109.818 178.947 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 62.46 67.47 0.72 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.16 -0.963 . . . . 40.0 111.077 178.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 61.15 43.21 11.34 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -0.825 . . . . 40.0 110.451 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.594 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.5 mm-40 -115.88 -77.92 0.57 Allowed 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.614 -1.304 . . . . 40.0 109.267 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.503 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.2 p -93.74 120.82 34.51 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.068 -1.02 . . . . 40.0 110.207 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.556 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 6.1 m-85 -102.73 83.77 2.31 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.378 0.609 . . . . 40.0 110.685 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.28 144.88 35.75 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.213 -0.995 . . . . 40.0 108.903 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.543 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 57.8 tttp -76.67 146.99 37.75 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.214 0.53 . . . . 40.0 110.322 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.821 HD11 HG22 ' A' ' 96' ' ' ILE . 15.6 pt -130.22 -28.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 109.148 -0.686 . . . . 40.0 109.148 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.603 HH11 ' HG2' ' A' ' 110' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 N-CA-C 109.128 -0.693 . . . . 40.0 109.128 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.68 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.8 t . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 109.249 -0.649 . . . . 40.0 109.249 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.587 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 10.6 mt -139.24 147.7 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.453 -0.78 . . . . 40.0 109.415 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -149.55 34.4 0.7 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.276 -0.89 . . . . 40.0 109.712 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.3 p -119.51 144.75 46.85 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.913 -0.715 . . . . 40.0 110.115 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.518 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 62.5 m-85 -45.6 -86.83 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.49 -0.757 . . . . 40.0 112.752 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.633 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -46.18 -48.05 17.61 Favored 'General case' 0 C--N 1.289 -2.061 0 O-C-N 121.672 -0.643 . . . . 40.0 109.761 -178.865 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.14 -53.35 23.62 Favored Glycine 0 N--CA 1.502 3.071 0 N-CA-C 110.149 -1.18 . . . . 40.0 110.149 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.83 -44.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 O-C-N 120.867 -1.372 . . . . 40.0 109.733 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 1.02 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.76 -57.06 14.09 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.257 -0.902 . . . . 40.0 109.934 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.99 -47.05 65.07 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 178.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.438 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.7 t80 -54.63 -50.26 68.54 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.901 0.858 . . . . 40.0 109.057 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.686 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 72.2 mt -70.72 -44.7 66.31 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.727 -0.608 . . . . 40.0 110.618 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.565 ' HG3' HD11 ' A' ' 96' ' ' ILE . 4.9 mt-30 -61.73 -26.86 68.32 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 119.122 -1.031 . . . . 40.0 110.722 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.9 m -102.28 -44.22 5.47 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.872 -1.143 . . . . 40.0 111.926 -178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.591 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.5 m-85 -102.85 -16.2 15.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.906 -1.121 . . . . 40.0 110.425 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.686 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 62.1 -27.58 0.06 Allowed 'General case' 0 N--CA 1.502 2.169 0 CA-C-O 121.36 0.6 . . . . 40.0 110.895 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -71.28 122.41 20.21 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 120.82 -1.175 . . . . 40.0 108.756 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.682 ' HA ' HD21 ' A' ' 14' ' ' LEU . 2.0 mt -47.29 132.36 9.76 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.428 -0.795 . . . . 40.0 109.144 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.52 ' HD2' HD23 ' A' ' 20' ' ' LEU . 71.5 Cg_exo -40.0 131.71 2.07 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 122.199 1.932 . . . . 40.0 112.626 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.625 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.47 78.59 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.876 0.845 . . . . 40.0 110.335 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.68 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 170.47 15.17 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.915 -0.491 . . . . 40.0 110.503 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.435 ' HA ' ' O ' ' A' ' 50' ' ' SER . 17.5 m-85 -114.18 167.13 10.95 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.497 -0.752 . . . . 40.0 111.233 -179.128 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.55 152.1 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 40.0 109.049 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.448 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 77.8 p -72.17 151.67 42.8 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 108.405 -0.961 . . . . 40.0 108.405 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.649 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -50.83 -51.9 46.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.759 -1.213 . . . . 40.0 108.38 177.883 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.7 t -46.32 -62.91 1.14 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.841 -0.537 . . . . 40.0 110.252 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.479 ' O ' HD12 ' A' ' 33' ' ' LEU . 45.2 mt-10 -48.74 -58.02 5.42 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.019 -0.734 . . . . 40.0 109.019 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.18 -49.33 64.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.591 -0.693 . . . . 40.0 109.575 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -64.86 -48.21 75.11 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.369 -0.832 . . . . 40.0 111.034 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -31.8 72.1 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 40.0 110.746 -179.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 29' ' ' GLU . 0.5 OUTLIER -66.92 -20.51 65.92 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.77 -0.826 . . . . 40.0 108.77 179.749 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.562 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 132.61 -3.66 5.05 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 120.127 -1.035 . . . . 40.0 111.031 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -60.94 114.32 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.549 -1.56 . . . . 40.0 108.318 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.8 142.85 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.376 -0.828 . . . . 40.0 110.48 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.46 -48.97 79.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.495 -0.753 . . . . 40.0 110.648 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 p -78.09 46.88 0.62 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.112 -0.992 . . . . 40.0 109.147 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -169.92 -50.37 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 108.824 -0.806 . . . . 40.0 108.824 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.92 20.23 75.96 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.1 -1.6 . . . . 40.0 109.1 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.562 HD21 ' C ' ' A' ' 34' ' ' GLY . 6.7 p-10 -55.19 127.23 28.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.68 -0.894 . . . . 40.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.576 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.4 tp -166.83 -55.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 108.533 -0.914 . . . . 40.0 108.533 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -29.74 53.41 Favored 'General case' 0 C--N 1.288 -2.069 0 O-C-N 121.052 -1.03 . . . . 40.0 110.065 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -62.73 1.34 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.396 -0.815 . . . . 40.0 109.443 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 24.4 m -71.57 -23.18 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-N 116.23 -0.441 . . . . 40.0 109.988 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.648 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.11 76.2 10.44 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 120.981 -1.075 . . . . 40.0 108.937 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -58.73 53.27 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.504 0 C-N-CA 122.391 2.06 . . . . 40.0 113.274 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.69 38.05 0.06 OUTLIER Glycine 0 N--CA 1.5 2.951 0 C-N-CA 119.913 -1.137 . . . . 40.0 111.577 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.648 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 19.9 tttt -119.72 148.34 43.51 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.795 -1.415 . . . . 40.0 110.092 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 5.2 m -120.26 134.8 55.19 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.136 -0.978 . . . . 40.0 109.93 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.461 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.9 mm -67.05 155.35 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -0.966 . . . . 40.0 110.815 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.527 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.43 148.08 4.67 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 119.615 -1.279 . . . . 40.0 110.257 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 123.53 15.99 3.53 Favored Glycine 0 N--CA 1.496 2.642 0 C-N-CA 119.865 -1.159 . . . . 40.0 110.997 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.649 ' CG ' ' HZ2' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -74.31 -168.87 0.71 Allowed 'General case' 0 C--O 1.192 -1.936 0 O-C-N 121.04 -1.27 . . . . 40.0 110.386 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -132.85 140.92 46.26 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 CA-C-O 121.728 0.775 . . . . 40.0 110.423 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -153.43 148.12 26.31 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.475 -0.765 . . . . 40.0 109.149 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.682 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.29 -19.96 20.22 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.465 -0.772 . . . . 40.0 110.211 -179.165 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.518 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.8 t30 69.95 31.19 3.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.448 -0.782 . . . . 40.0 111.889 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.682 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.4 mtm-85 -59.02 -31.15 68.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.821 -1.174 . . . . 40.0 108.129 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.466 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 22.0 mp0 -62.88 -8.92 7.95 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.228 -0.656 . . . . 40.0 109.228 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 58.55 44.05 95.7 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.367 -1.093 . . . . 40.0 110.367 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.664 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.61 -12.29 25.86 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.61 -0.935 . . . . 40.0 108.78 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.603 HD21 ' CD2' ' A' ' 106' ' ' PHE . 28.3 mt -136.2 162.69 55.06 Favored Pre-proline 0 N--CA 1.499 2.024 0 N-CA-C 108.135 -1.061 . . . . 40.0 108.135 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.443 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 93.5 Cg_exo -42.78 142.32 2.14 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 121.98 1.786 . . . . 40.0 112.622 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.609 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.62 -166.42 11.5 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.002 -1.239 . . . . 40.0 110.002 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.5 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.0 pttm 171.5 -158.48 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 107.126 -1.435 . . . . 40.0 107.126 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 67' ' ' SER . 51.0 p -72.4 87.71 1.17 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 107.012 -1.477 . . . . 40.0 107.012 177.013 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.5 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.42 103.97 0.11 Allowed Glycine 0 N--CA 1.498 2.772 0 N-CA-C 109.559 -1.416 . . . . 40.0 109.559 -178.256 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.618 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -124.02 140.85 52.57 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.529 -0.983 . . . . 40.0 110.347 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.64 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 24.1 p -105.99 130.04 54.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.279 -1.008 . . . . 40.0 108.279 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.559 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 31.3 m95 -124.27 140.38 53.02 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.726 -0.789 . . . . 40.0 110.585 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.592 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.7 OUTLIER -143.5 149.55 37.67 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.286 -0.883 . . . . 40.0 108.926 -179.673 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.636 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -116.76 175.34 5.62 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.293 -0.879 . . . . 40.0 112.65 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.527 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -162.24 142.53 10.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.557 -0.715 . . . . 40.0 110.27 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.656 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -67.73 153.17 44.31 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.74 -0.6 . . . . 40.0 110.844 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.518 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 13.8 mm -136.93 151.61 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.382 -0.823 . . . . 40.0 109.798 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.9 m-20 57.27 53.71 7.43 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.143 0.496 . . . . 40.0 111.98 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.576 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 60.3 t80 -118.1 155.14 30.91 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.159 -0.963 . . . . 40.0 109.123 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 42.0 p -133.28 -78.2 0.48 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.716 0.769 . . . . 40.0 109.876 178.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.74 102.94 2.89 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 109.078 -0.712 . . . . 40.0 109.078 -179.546 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -105.95 0.29 Allowed Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.788 -1.325 . . . . 40.0 109.788 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.431 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 14.1 t80 -126.38 -175.83 3.49 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -1.031 . . . . 40.0 109.942 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.432 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.5 mtm180 -84.75 -153.44 0.16 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.417 -0.802 . . . . 40.0 110.38 -178.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -163.7 -135.13 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.759 -0.83 . . . . 40.0 108.759 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' A' ' 100' ' ' THR . 28.1 p -113.84 -10.55 12.96 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.975 -1.078 . . . . 40.0 109.791 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.625 ' OD1' HG22 ' A' ' 100' ' ' THR . 14.1 m-20 -73.91 108.21 6.59 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 120.858 0.361 . . . . 40.0 110.821 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.828 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.03 140.48 45.64 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.469 -0.892 . . . . 40.0 110.391 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.619 HD11 HG21 ' A' ' 96' ' ' ILE . 18.1 tt -111.33 148.33 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 CA-C-O 122.108 0.956 . . . . 40.0 109.917 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.525 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.6 mm? -124.82 128.74 49.18 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.478 -0.764 . . . . 40.0 109.082 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.25 141.58 50.02 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.273 -0.892 . . . . 40.0 109.67 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.559 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.7 p -106.52 179.57 4.23 Favored 'General case' 0 N--CA 1.505 2.314 0 CA-C-O 122.51 1.148 . . . . 40.0 112.666 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.64 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.82 -51.98 58.8 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.381 1.086 . . . . 40.0 109.118 177.863 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.618 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 5.1 1.24 Allowed 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 114.673 -1.149 . . . . 40.0 110.2 -178.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.494 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 61.6 m95 72.76 11.52 5.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.882 -0.511 . . . . 40.0 112.097 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' A' ' 95' ' ' LEU . 23.1 mt -67.73 125.14 25.29 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 119.947 -1.72 . . . . 40.0 107.835 178.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 1.02 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.2 mt -112.62 133.25 59.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 122.865 1.317 . . . . 40.0 112.724 -176.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.565 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 16.0 m-85 -125.21 157.68 35.89 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 107.77 -1.196 . . . . 40.0 107.77 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.429 ' HB2' ' NZ ' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.92 141.24 51.6 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 119.205 -0.998 . . . . 40.0 112.934 -177.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.83 131.33 40.9 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.484 -1.302 . . . . 40.0 107.484 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.625 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.9 p -116.44 10.35 14.6 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 109.397 -0.594 . . . . 40.0 109.397 -178.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.573 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -115.3 33.16 5.6 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.585 -0.846 . . . . 40.0 109.854 179.293 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 63.98 66.68 0.64 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.262 -0.899 . . . . 40.0 111.071 178.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 60.88 43.25 12.03 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.386 -0.821 . . . . 40.0 110.108 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.573 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.4 mm-40 -116.26 -76.92 0.57 Allowed 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.712 -1.243 . . . . 40.0 109.217 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.554 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.9 p -94.81 121.96 36.94 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.664 -1.273 . . . . 40.0 110.433 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.603 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.7 m-85 -102.9 86.14 2.67 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 40.0 110.584 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.5 m -79.28 146.42 32.99 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.197 -1.001 . . . . 40.0 108.334 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.565 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 57.5 tttp -78.28 146.32 34.89 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.304 0.573 . . . . 40.0 110.371 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.788 HD11 ' CG2' ' A' ' 96' ' ' ILE . 29.1 pt -126.97 -31.66 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 N-CA-C 108.933 -0.766 . . . . 40.0 108.933 177.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.633 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.586 -0.721 . . . . 40.0 109.269 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.658 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.7 t . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 109.488 -0.56 . . . . 40.0 109.488 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.538 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.3 mt -137.97 149.74 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.461 -0.774 . . . . 40.0 109.419 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -149.22 36.07 0.74 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.046 -1.034 . . . . 40.0 109.745 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p -119.9 140.51 50.75 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.451 -0.9 . . . . 40.0 110.518 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.581 ' CE2' HG21 ' A' ' 76' ' ' ILE . 74.3 m-85 -41.2 -80.66 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.179 0.514 . . . . 40.0 111.746 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.544 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -50.65 -45.83 58.07 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.566 -0.709 . . . . 40.0 111.108 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.04 -52.0 37.69 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 109.977 -1.249 . . . . 40.0 109.977 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.47 -44.27 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.404 -1.056 . . . . 40.0 109.672 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.823 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.66 -55.04 40.17 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.681 0.753 . . . . 40.0 109.408 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -44.36 88.66 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.953 -0.758 . . . . 40.0 108.953 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.513 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.9 t80 -56.91 -48.24 78.7 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 122.233 1.016 . . . . 40.0 108.52 178.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.537 HD21 ' HA ' ' A' ' 20' ' ' LEU . 39.8 mt -68.73 -45.7 70.82 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.774 -0.579 . . . . 40.0 110.3 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -65.17 -24.34 67.35 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 118.66 -1.216 . . . . 40.0 111.22 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.3 m -98.27 -43.79 6.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.845 -1.159 . . . . 40.0 111.571 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.581 ' C ' ' H ' ' A' ' 19' ' ' LYS . 74.5 m-85 -108.98 -11.98 14.92 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.188 -0.945 . . . . 40.0 111.223 -177.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.497 ' CG ' ' CZ2' ' A' ' 94' ' ' TRP . 2.3 m-70 61.27 -25.62 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 121.567 0.699 . . . . 40.0 111.041 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.588 ' NZ ' ' OD2' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -72.9 121.55 20.19 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 120.313 -1.492 . . . . 40.0 108.988 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.537 ' HA ' HD21 ' A' ' 14' ' ' LEU . 4.0 mt -48.02 129.34 12.07 Favored Pre-proline 0 C--N 1.283 -2.309 0 O-C-N 121.463 -0.773 . . . . 40.0 109.281 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.426 ' O ' ' N ' ' A' ' 23' ' ' ASN . 73.9 Cg_exo -33.62 133.48 0.12 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.624 2.216 . . . . 40.0 113.052 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.588 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -64.0 74.98 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.653 0.739 . . . . 40.0 110.258 -179.354 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.658 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 171.72 18.21 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.719 -0.613 . . . . 40.0 110.322 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -115.28 165.15 13.27 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.601 -0.687 . . . . 40.0 110.735 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -155.93 149.87 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 108.744 -0.835 . . . . 40.0 108.744 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.406 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 69.8 p -69.47 153.68 43.16 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.422 -0.799 . . . . 40.0 110.02 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.29 -51.46 58.44 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.14 -1.43 . . . . 40.0 107.14 177.042 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.8 t -47.36 -62.23 1.53 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.48 -0.763 . . . . 40.0 110.362 178.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 38.9 mt-10 -49.28 -57.2 7.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.356 -0.84 . . . . 40.0 109.356 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.04 -49.43 66.33 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.674 0.749 . . . . 40.0 109.79 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -63.58 -49.59 72.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.728 -0.607 . . . . 40.0 110.16 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.51 -30.02 68.75 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 40.0 110.519 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 mt -66.72 -19.73 65.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.107 -0.996 . . . . 40.0 109.077 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.523 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.74 -1.4 5.14 Favored Glycine 0 N--CA 1.499 2.835 0 C-N-CA 120.073 -1.061 . . . . 40.0 111.143 179.207 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -61.54 114.88 3.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.657 -1.496 . . . . 40.0 109.301 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.8 t -123.32 140.24 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 O-C-N 121.262 -0.899 . . . . 40.0 109.962 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.39 -49.36 78.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 40.0 110.171 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 p -76.64 47.55 0.5 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.218 -0.926 . . . . 40.0 109.425 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -170.89 -49.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.645 -0.659 . . . . 40.0 109.283 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.62 17.4 74.78 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 109.173 -1.571 . . . . 40.0 109.173 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.523 HD21 ' C ' ' A' ' 34' ' ' GLY . 7.4 p-10 -55.61 130.95 45.09 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.455 -1.026 . . . . 40.0 108.946 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.588 HD11 HD11 ' A' ' 51' ' ' ILE . 1.4 tp -169.85 -55.77 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.704 -1.221 . . . . 40.0 107.704 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.76 -27.38 63.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.324 -0.86 . . . . 40.0 110.241 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.02 -57.31 3.95 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.847 0.832 . . . . 40.0 109.455 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.2 m -72.54 -29.4 30.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.955 -1.128 . . . . 40.0 107.955 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.565 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -143.05 79.38 14.48 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 121.557 -0.714 . . . . 40.0 110.306 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.11 54.9 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 122.081 1.854 . . . . 40.0 113.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.12 40.7 0.06 OUTLIER Glycine 0 N--CA 1.503 3.135 0 C-N-CA 119.758 -1.211 . . . . 40.0 111.408 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 15.2 tttt -121.54 138.99 54.07 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.947 -1.325 . . . . 40.0 109.872 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 m -111.99 132.43 54.79 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.032 -1.043 . . . . 40.0 109.283 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.588 HD11 HD11 ' A' ' 42' ' ' LEU . 4.3 mm -63.54 151.29 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.373 -0.829 . . . . 40.0 110.028 -179.114 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.405 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 152.98 144.49 3.92 Favored Glycine 0 N--CA 1.488 2.116 0 C-N-CA 118.789 -1.672 . . . . 40.0 110.651 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 126.79 15.33 2.64 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 119.841 -1.171 . . . . 40.0 111.225 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.565 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -72.79 -170.36 0.69 Allowed 'General case' 0 C--O 1.198 -1.63 0 O-C-N 120.841 -1.388 . . . . 40.0 110.205 -179.291 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 5.6 mm -134.11 138.96 49.27 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-O 121.489 0.662 . . . . 40.0 110.203 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -151.03 148.83 28.83 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.581 -0.699 . . . . 40.0 109.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.693 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.68 -21.16 19.53 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.504 -0.748 . . . . 40.0 110.777 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.509 HD21 ' H ' ' A' ' 63' ' ' LEU . 66.3 t30 71.12 28.12 3.15 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 40.0 111.839 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.693 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.7 mtm-85 -56.64 -32.36 65.27 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.957 -1.089 . . . . 40.0 108.151 178.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.433 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 24.6 mp0 -63.46 -9.22 11.73 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.401 -0.592 . . . . 40.0 109.401 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.93 44.66 97.86 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.236 -1.146 . . . . 40.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.663 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -93.8 -12.85 28.16 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.649 -0.912 . . . . 40.0 108.552 179.679 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.638 HD21 ' CD2' ' A' ' 106' ' ' PHE . 36.5 mt -138.04 166.57 25.01 Favored Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 108.744 -0.836 . . . . 40.0 108.744 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.6 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 81.7 Cg_exo -46.36 136.57 15.11 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 121.862 1.708 . . . . 40.0 112.387 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.622 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -125.81 -168.56 12.7 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.436 -1.466 . . . . 40.0 109.436 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.592 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 4.0 pttm 175.35 -156.28 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 106.867 -1.531 . . . . 40.0 106.867 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.428 ' O ' ' OG ' ' A' ' 67' ' ' SER . 41.2 p -75.85 87.15 2.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.32 -1.487 . . . . 40.0 107.155 177.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.592 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 76.89 105.83 0.15 Allowed Glycine 0 N--CA 1.497 2.756 0 N-CA-C 108.262 -1.935 . . . . 40.0 108.262 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.622 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.1 tpp180 -128.08 142.72 51.13 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.388 -1.066 . . . . 40.0 110.419 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.606 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.75 130.07 55.37 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 108.89 -0.782 . . . . 40.0 108.89 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.6 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 31.3 m95 -123.33 143.57 50.01 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 119.931 -0.708 . . . . 40.0 110.838 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.565 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.6 OUTLIER -145.28 148.47 33.5 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.243 -0.91 . . . . 40.0 109.693 -179.363 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -115.39 169.74 8.93 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.227 -0.92 . . . . 40.0 111.856 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.405 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -156.01 144.37 20.01 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.336 -0.616 . . . . 40.0 109.336 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.643 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -69.59 154.32 42.17 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.621 -0.674 . . . . 40.0 110.631 -178.779 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.581 HG21 ' CE2' ' A' ' 7' ' ' PHE . 16.9 mm -137.08 152.67 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.164 -0.96 . . . . 40.0 109.908 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.498 HD22 ' CG ' ' A' ' 86' ' ' ASP . 74.3 m-20 56.35 57.18 5.11 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.031 0.444 . . . . 40.0 111.492 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.466 ' CG ' ' N ' ' A' ' 79' ' ' THR . 65.1 t80 -120.85 153.66 36.83 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.257 -0.902 . . . . 40.0 109.317 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.2 p -132.55 -78.63 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.888 0.851 . . . . 40.0 109.602 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.44 102.17 2.72 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.855 -0.794 . . . . 40.0 108.855 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.48 -104.92 0.26 Allowed Glycine 0 N--CA 1.498 2.819 0 C-N-CA 119.557 -1.306 . . . . 40.0 109.961 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.1 t80 -126.59 -176.15 3.6 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.638 -0.919 . . . . 40.0 109.453 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.419 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.6 mtm180 -84.19 -150.69 0.12 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.379 -0.826 . . . . 40.0 110.212 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.444 HD21 ' HB2' ' A' ' 86' ' ' ASP . 41.9 p-10 -164.77 -134.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.567 -0.901 . . . . 40.0 108.567 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 26.5 p -115.66 -9.78 11.92 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.048 -1.033 . . . . 40.0 109.681 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.638 ' OD1' HG22 ' A' ' 100' ' ' THR . 20.3 m-20 -75.17 108.76 8.13 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 120.798 0.332 . . . . 40.0 110.821 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.832 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.22 140.15 45.06 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.34 -0.944 . . . . 40.0 109.734 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.666 HD11 HG21 ' A' ' 96' ' ' ILE . 13.8 tt -109.75 148.48 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 CA-C-O 122.019 0.914 . . . . 40.0 110.137 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.583 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.8 mm? -124.18 129.15 50.32 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.768 -0.827 . . . . 40.0 108.768 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.512 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 5.6 p90 -132.53 140.94 48.53 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 109.658 -0.497 . . . . 40.0 109.658 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 71.5 p -107.54 -178.86 3.75 Favored 'General case' 0 N--CA 1.506 2.366 0 CA-C-O 122.292 1.044 . . . . 40.0 112.504 -177.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.606 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -55.5 -50.17 70.65 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 122.193 0.997 . . . . 40.0 109.216 177.493 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.565 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -68.07 1.07 2.99 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.022 -0.99 . . . . 40.0 109.536 -179.375 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 77.2 m95 73.01 17.2 4.2 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 122.089 -0.382 . . . . 40.0 111.116 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.513 ' HA ' HD23 ' A' ' 95' ' ' LEU . 23.4 mt -70.39 125.45 26.85 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.146 -1.428 . . . . 40.0 107.146 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.823 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.6 mp -113.11 133.88 57.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 CA-C-O 122.767 1.27 . . . . 40.0 112.357 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.576 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.1 m-85 -126.75 158.83 35.48 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 107.985 -1.117 . . . . 40.0 107.985 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.431 ' NZ ' ' CZ ' ' A' ' 7' ' ' PHE . 4.8 ptmm? -127.71 142.18 51.4 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.218 -0.993 . . . . 40.0 112.983 -177.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.4 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -132.26 130.84 41.43 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.567 -1.272 . . . . 40.0 107.567 176.813 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.638 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.1 p -115.88 8.51 14.76 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 109.534 -0.543 . . . . 40.0 109.534 -178.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.581 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.74 31.62 6.4 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.845 -0.742 . . . . 40.0 110.016 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 65.22 67.27 0.52 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.104 -0.998 . . . . 40.0 111.04 178.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 61.04 43.0 11.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.409 -0.807 . . . . 40.0 110.398 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.581 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 26.6 mm-40 -116.65 -77.39 0.57 Allowed 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.57 -1.331 . . . . 40.0 109.603 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.519 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 20.4 p -94.61 122.41 37.18 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.98 -1.075 . . . . 40.0 110.096 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.638 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.1 m-85 -103.91 84.87 2.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.558 -0.713 . . . . 40.0 110.385 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.5 m -78.24 143.74 36.83 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.918 -1.114 . . . . 40.0 108.519 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.576 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 58.2 tttp -75.03 143.39 43.55 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.666 -0.646 . . . . 40.0 110.621 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.757 HD11 HG22 ' A' ' 96' ' ' ILE . 31.9 pt -124.29 -29.96 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.798 -0.815 . . . . 40.0 108.798 177.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.554 HH11 ' HG2' ' A' ' 110' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.042 0 CA-C-O 118.719 -0.658 . . . . 40.0 109.304 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.689 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.2 t . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 109.145 -0.687 . . . . 40.0 109.145 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.552 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -139.06 147.61 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.336 -0.853 . . . . 40.0 109.433 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -147.22 33.35 0.89 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.335 -0.853 . . . . 40.0 110.349 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.6 p -117.79 142.17 47.59 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.571 0.701 . . . . 40.0 110.699 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.576 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 66.2 m-85 -42.52 -85.64 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 CA-C-O 122.229 1.014 . . . . 40.0 113.392 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.661 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -45.84 -48.27 15.83 Favored 'General case' 0 C--N 1.285 -2.21 0 O-C-N 121.527 -0.733 . . . . 40.0 109.896 -179.952 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.6 -53.82 23.66 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 110.353 -1.099 . . . . 40.0 110.353 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.9 t -63.99 -44.24 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.349 -1.089 . . . . 40.0 109.725 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 1.09 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.97 -54.2 49.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.915 -1.116 . . . . 40.0 109.961 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -45.43 74.68 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.447 0.641 . . . . 40.0 109.505 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.597 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.7 t80 -56.74 -49.77 74.23 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.063 -1.088 . . . . 40.0 108.063 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.703 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.4 mt -68.29 -44.42 75.53 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.897 -0.721 . . . . 40.0 109.592 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.538 ' HG3' HD11 ' A' ' 96' ' ' ILE . 8.1 mt-30 -65.37 -24.1 67.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.715 -1.241 . . . . 40.0 111.154 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 m -99.9 -50.2 4.09 Favored 'General case' 0 N--CA 1.516 2.842 0 O-C-N 121.106 -0.997 . . . . 40.0 111.809 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.631 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.7 m-85 -98.95 -16.23 18.83 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 120.92 -1.112 . . . . 40.0 111.76 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.703 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.12 -19.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 121.395 0.617 . . . . 40.0 111.206 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.631 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -74.1 118.39 17.0 Favored 'General case' 0 C--N 1.291 -1.961 0 O-C-N 121.295 -0.878 . . . . 40.0 109.822 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.575 ' HA ' HD21 ' A' ' 14' ' ' LEU . 4.8 mt -43.84 128.14 4.17 Favored Pre-proline 0 N--CA 1.498 1.936 0 N-CA-C 107.505 -1.294 . . . . 40.0 107.505 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.468 ' HD2' HD23 ' A' ' 20' ' ' LEU . 52.8 Cg_exo -36.46 134.0 0.33 Allowed 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.008 2.472 . . . . 40.0 112.575 -178.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.627 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -63.76 78.21 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.6 -0.688 . . . . 40.0 110.254 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.689 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 168.24 16.27 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.468 -0.77 . . . . 40.0 110.399 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.417 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.8 m-85 -115.13 166.05 12.25 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 122.021 0.915 . . . . 40.0 110.944 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -155.7 151.25 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.186 -0.947 . . . . 40.0 109.022 178.928 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 53' ' ' GLY . 80.5 p -70.58 154.43 41.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.34 -0.85 . . . . 40.0 110.241 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.62 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.59 -51.72 58.56 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.228 -1.397 . . . . 40.0 107.228 177.138 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.7 t -46.58 -62.94 1.15 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.615 -0.678 . . . . 40.0 110.064 178.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -47.62 -58.15 4.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.408 -0.807 . . . . 40.0 109.435 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.457 ' HB2' HD12 ' A' ' 25' ' ' ILE . . . -52.71 -50.3 63.63 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.493 -0.755 . . . . 40.0 109.526 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.16 -49.86 72.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.849 -0.532 . . . . 40.0 110.768 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.48 -29.62 68.29 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.23 -0.919 . . . . 40.0 110.467 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -17.02 64.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.767 -1.208 . . . . 40.0 109.079 178.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.523 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 128.12 1.18 6.31 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 120.376 -0.916 . . . . 40.0 111.434 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -64.25 115.56 5.15 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.469 -1.606 . . . . 40.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 51.8 t -122.97 143.29 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 121.355 -0.841 . . . . 40.0 110.401 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.84 -49.09 76.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.572 -0.705 . . . . 40.0 109.97 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 p -78.69 50.62 1.0 Allowed 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.698 -0.853 . . . . 40.0 108.698 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 tttp -172.83 -51.44 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.738 -0.838 . . . . 40.0 108.738 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.99 20.33 76.15 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 108.939 -1.665 . . . . 40.0 108.939 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.523 HD21 ' C ' ' A' ' 34' ' ' GLY . 6.2 p-10 -55.73 128.08 33.1 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.987 -0.746 . . . . 40.0 108.987 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.678 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.1 tp -166.86 -56.65 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.917 0.865 . . . . 40.0 109.074 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.39 -28.57 59.65 Favored 'General case' 0 C--N 1.289 -2.039 0 O-C-N 121.14 -0.975 . . . . 40.0 110.384 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.5 -62.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.532 -0.73 . . . . 40.0 109.299 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.409 ' H ' HG22 ' A' ' 45' ' ' VAL . 14.7 m -69.41 -29.66 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 CA-C-O 121.543 0.687 . . . . 40.0 109.977 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.599 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -142.93 78.55 15.35 Favored Pre-proline 0 C--N 1.299 -1.589 0 O-C-N 121.193 -0.942 . . . . 40.0 109.116 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -56.14 51.33 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 122.349 2.033 . . . . 40.0 114.685 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.25 0.06 OUTLIER Glycine 0 N--CA 1.502 3.087 0 C-N-CA 119.463 -1.351 . . . . 40.0 111.112 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 23.8 tttt -122.92 146.19 47.81 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.757 -1.437 . . . . 40.0 109.329 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.417 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 7.6 m -117.3 131.77 56.74 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.708 -1.245 . . . . 40.0 110.848 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.478 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 8.0 mm -60.27 149.14 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-O 121.63 0.728 . . . . 40.0 110.866 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.419 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 151.94 147.1 4.49 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.152 -1.499 . . . . 40.0 110.916 179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.443 ' O ' HG22 ' A' ' 26' ' ' THR . . . 123.32 17.95 3.17 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.682 -0.77 . . . . 40.0 111.603 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.606 ' OD2' ' NZ ' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -74.21 -169.56 0.81 Allowed 'General case' 0 C--O 1.195 -1.774 0 O-C-N 120.801 -1.411 . . . . 40.0 110.074 -179.331 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.19 139.13 50.01 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.801 0 CA-C-O 121.761 0.791 . . . . 40.0 110.2 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -150.3 147.79 28.06 Favored 'General case' 0 C--N 1.293 -1.882 0 C-N-CA 119.926 -0.71 . . . . 40.0 109.96 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.702 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -95.06 -16.66 22.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.818 -0.551 . . . . 40.0 110.03 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.51 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 67.1 t30 68.11 28.46 6.6 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 40.0 111.785 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.702 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.3 mtm-85 -56.78 -31.82 65.03 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.919 -1.113 . . . . 40.0 108.475 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.45 ' CD ' ' N ' ' A' ' 60' ' ' GLU . 21.1 mp0 -61.85 -13.02 20.43 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.344 -0.613 . . . . 40.0 109.344 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.63 43.89 98.33 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.839 -1.304 . . . . 40.0 109.839 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.644 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -94.47 -12.36 27.86 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.476 -0.935 . . . . 40.0 108.476 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.581 HD21 ' CD2' ' A' ' 106' ' ' PHE . 31.9 mt -136.26 163.75 47.81 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 109.014 -0.736 . . . . 40.0 109.014 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.569 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 92.1 Cg_exo -43.26 137.61 5.06 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.987 1.791 . . . . 40.0 112.366 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.539 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.19 -169.5 12.51 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.065 -1.214 . . . . 40.0 110.065 -178.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.469 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.9 ptmm? 173.9 -158.81 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.138 -1.43 . . . . 40.0 107.138 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 67' ' ' SER . 24.4 p -73.33 88.51 1.55 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.034 -1.469 . . . . 40.0 107.034 177.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.469 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 74.79 103.98 0.09 OUTLIER Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.016 -1.634 . . . . 40.0 109.016 -177.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.607 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.0 tpp180 -125.41 143.06 51.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.942 -0.74 . . . . 40.0 109.467 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.639 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 35.2 p -109.78 133.24 53.37 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.832 -1.173 . . . . 40.0 107.832 178.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.608 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 32.7 m95 -127.17 141.37 51.76 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.815 0.817 . . . . 40.0 110.474 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.629 HH12 ' HA ' ' A' ' 92' ' ' SER . 1.0 OUTLIER -144.89 146.67 32.13 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.54 -0.725 . . . . 40.0 109.378 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.62 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -113.93 172.97 6.66 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.154 -0.966 . . . . 40.0 112.354 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -159.22 143.7 15.42 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.766 -0.584 . . . . 40.0 109.734 179.146 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.617 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.69 156.37 35.45 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.471 -0.768 . . . . 40.0 110.617 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.576 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 13.8 mm -139.69 152.13 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 40.0 109.463 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.505 HD22 ' CG ' ' A' ' 86' ' ' ASP . 70.7 m-20 56.29 54.93 7.15 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.117 -0.492 . . . . 40.0 111.616 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.678 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 52.7 t80 -116.72 155.49 28.78 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.997 -1.065 . . . . 40.0 108.968 177.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.577 ' OG1' ' N ' ' A' ' 80' ' ' SER . 32.9 p -132.84 -78.08 0.49 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.82 0.819 . . . . 40.0 109.904 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.577 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.0 OUTLIER -152.47 102.73 2.76 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.155 -1.054 . . . . 40.0 108.155 -179.568 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 151.87 -108.16 0.36 Allowed Glycine 0 N--CA 1.501 3.022 0 N-CA-C 109.762 -1.335 . . . . 40.0 109.762 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.487 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 20.1 t80 -124.67 -178.06 4.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.304 -1.115 . . . . 40.0 109.357 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.487 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 1.3 mtm180 -83.44 -151.49 0.11 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.795 0.807 . . . . 40.0 110.806 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.413 HD21 ' HB2' ' A' ' 77' ' ' ASN . 40.5 p30 -164.6 -133.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.782 -0.822 . . . . 40.0 108.782 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.482 ' OG ' ' O ' ' A' ' 100' ' ' THR . 24.5 p -116.08 -9.88 11.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.033 -1.042 . . . . 40.0 110.249 -179.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.655 ' OD1' HG22 ' A' ' 100' ' ' THR . 17.9 m-20 -74.65 110.9 9.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 122.172 -0.33 . . . . 40.0 110.595 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.831 ' HG2' ' NH1' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -137.15 140.14 41.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.237 -0.914 . . . . 40.0 109.83 179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.629 ' O ' HD22 ' A' ' 89' ' ' LEU . 11.1 tt -110.35 148.79 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 122.389 1.09 . . . . 40.0 110.205 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.629 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -125.62 128.01 47.2 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.663 -0.648 . . . . 40.0 109.323 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.524 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.46 142.61 50.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.479 -0.763 . . . . 40.0 109.249 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.608 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 90.0 p -107.34 178.51 4.52 Favored 'General case' 0 N--CA 1.504 2.241 0 CA-C-O 122.128 0.966 . . . . 40.0 112.679 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.639 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.42 -51.86 56.91 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-O 122.176 0.988 . . . . 40.0 109.059 177.625 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.607 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.03 5.24 1.22 Allowed 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 114.87 -1.059 . . . . 40.0 109.742 -179.002 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.588 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 77.1 m95 69.53 19.69 7.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 122.05 -0.406 . . . . 40.0 111.608 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.518 ' HA ' HD23 ' A' ' 95' ' ' LEU . 21.7 mt -72.87 127.61 33.05 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.285 -1.746 . . . . 40.0 106.285 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 1.09 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.4 mp -112.97 135.99 50.67 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.103 0 CA-C-O 122.914 1.34 . . . . 40.0 111.751 -177.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.628 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.9 m-85 -127.72 158.08 38.59 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 107.75 -1.204 . . . . 40.0 107.75 178.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.427 ' HD2' ' CG2' ' A' ' 109' ' ' ILE . 6.0 ptmm? -127.08 142.64 51.47 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.056 -1.027 . . . . 40.0 112.124 -178.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.48 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.86 129.89 37.08 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.973 -1.491 . . . . 40.0 106.973 178.151 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.655 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.4 p -117.07 9.07 13.51 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 109.506 -0.553 . . . . 40.0 109.506 -177.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.569 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.97 33.4 5.25 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.584 -0.846 . . . . 40.0 109.772 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 64.58 66.27 0.6 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.042 -1.036 . . . . 40.0 110.826 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 60.7 42.74 13.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.479 -0.763 . . . . 40.0 110.408 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.569 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.2 mm-40 -115.53 -77.64 0.57 Allowed 'General case' 0 N--CA 1.509 2.49 0 O-C-N 120.701 -1.249 . . . . 40.0 109.551 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.536 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 19.7 p -93.03 121.1 34.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.606 -1.309 . . . . 40.0 110.177 -178.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.581 ' CD2' HD21 ' A' ' 63' ' ' LEU . 6.7 m-85 -102.33 83.7 2.36 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.644 -0.66 . . . . 40.0 110.911 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.1 m -76.35 144.35 40.18 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 122.106 0.955 . . . . 40.0 109.344 177.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.628 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 57.8 tttp -76.8 146.13 38.04 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 121.496 -0.753 . . . . 40.0 110.031 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.778 HD11 HG22 ' A' ' 96' ' ' ILE . 31.8 pt -127.61 -31.54 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 120.049 -0.66 . . . . 40.0 109.305 178.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.661 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.501 2.121 0 N-CA-C 108.817 -0.809 . . . . 40.0 108.817 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.649 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.542 -0.54 . . . . 40.0 109.542 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.587 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.12 146.49 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.648 -0.658 . . . . 40.0 109.463 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -148.67 32.69 0.78 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.114 -0.991 . . . . 40.0 109.305 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.0 p -119.54 141.56 49.12 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.502 -0.879 . . . . 40.0 110.58 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.562 ' CE2' HG21 ' A' ' 76' ' ' ILE . 58.9 m-85 -41.84 -87.37 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 N-CA-C 113.486 0.921 . . . . 40.0 113.486 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.658 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -47.57 -46.16 27.75 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.316 -0.865 . . . . 40.0 109.878 -179.494 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.87 47.95 Favored Glycine 0 N--CA 1.497 2.708 0 N-CA-C 110.043 -1.223 . . . . 40.0 110.043 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.44 -43.88 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.124 -1.221 . . . . 40.0 109.368 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.828 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -57.2 -54.6 44.96 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.557 0.694 . . . . 40.0 109.785 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -49.18 67.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.558 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.1 t80 -51.81 -51.31 57.39 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.952 0.882 . . . . 40.0 109.309 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.603 HD21 ' HA ' ' A' ' 20' ' ' LEU . 66.0 mt -70.04 -45.77 66.46 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.725 -0.61 . . . . 40.0 111.463 -179.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -62.64 -24.2 67.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.853 -1.154 . . . . 40.0 110.568 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.5 m -101.66 -49.22 4.06 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 120.481 -1.387 . . . . 40.0 111.182 -178.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.55 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.4 m-85 -101.64 -14.05 17.57 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.525 -0.735 . . . . 40.0 110.784 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.536 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.8 m-70 61.78 -25.72 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.096 -1.002 . . . . 40.0 111.788 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.588 ' NZ ' ' OD2' ' A' ' 22' ' ' ASP . 0.4 OUTLIER -73.8 123.76 24.78 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.518 -1.364 . . . . 40.0 109.847 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.617 HD23 ' HD2' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -48.65 128.86 13.9 Favored Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.426 -0.796 . . . . 40.0 109.339 179.013 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.617 ' HD2' HD23 ' A' ' 20' ' ' LEU . 46.4 Cg_exo -37.62 131.28 0.72 Allowed 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.411 2.074 . . . . 40.0 112.08 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -63.34 78.4 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.838 0.828 . . . . 40.0 110.11 -179.108 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.649 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 170.26 14.44 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.861 -0.524 . . . . 40.0 110.759 -179.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.432 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.9 m-85 -114.17 164.82 13.36 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.84 0.829 . . . . 40.0 111.834 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.79 150.28 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.345 -0.847 . . . . 40.0 109.695 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.433 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 68.2 p -73.07 150.54 42.23 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.227 -0.92 . . . . 40.0 108.708 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.645 ' NZ ' ' OD1' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -48.29 -53.09 18.52 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.802 -1.185 . . . . 40.0 107.802 178.321 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.0 t -46.33 -62.2 1.46 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.445 -0.784 . . . . 40.0 110.714 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.433 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 36.1 mt-10 -50.73 -56.07 13.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.874 -1.141 . . . . 40.0 109.009 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.83 -51.07 59.26 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.264 -0.898 . . . . 40.0 109.768 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.79 -48.35 77.23 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.844 -0.535 . . . . 40.0 110.829 -179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -30.67 69.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.368 -0.833 . . . . 40.0 110.467 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.67 -18.49 64.28 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.17 -0.956 . . . . 40.0 108.759 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.585 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 130.6 -0.7 5.52 Favored Glycine 0 N--CA 1.503 3.157 0 C-N-CA 120.192 -1.004 . . . . 40.0 111.02 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -62.84 113.29 2.96 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.544 -1.563 . . . . 40.0 109.074 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -122.09 141.86 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.344 -0.847 . . . . 40.0 111.032 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.13 -47.32 86.78 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.18 -0.95 . . . . 40.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.5 p -78.52 49.95 0.91 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.735 -1.228 . . . . 40.0 109.258 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -174.27 -49.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.204 -0.665 . . . . 40.0 109.204 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.02 24.42 73.15 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.194 -1.562 . . . . 40.0 109.194 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.585 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.7 p-10 -57.18 130.17 45.0 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.762 -0.846 . . . . 40.0 108.803 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.746 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 6.2 tp -169.34 -56.81 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.932 -0.766 . . . . 40.0 108.932 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.46 -27.18 35.69 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.751 -1.218 . . . . 40.0 109.803 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.42 -66.14 0.81 Allowed 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.583 0.706 . . . . 40.0 109.629 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.0 m -69.06 -27.13 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.475 -0.766 . . . . 40.0 110.615 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.663 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -143.82 78.35 14.22 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.936 . . . . 40.0 108.494 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -59.42 54.15 0.07 OUTLIER 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 123.409 2.74 . . . . 40.0 113.644 -178.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.34 40.85 0.07 OUTLIER Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.505 -1.331 . . . . 40.0 110.39 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.663 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 26.8 tttt -120.72 148.66 43.65 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.265 -1.138 . . . . 40.0 110.403 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 4.4 m -120.86 132.0 54.73 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.115 -0.991 . . . . 40.0 110.726 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 1.7 mm -65.05 155.43 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 CA-C-O 122.55 1.167 . . . . 40.0 111.015 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.544 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.84 154.4 6.4 Favored Glycine 0 N--CA 1.483 1.798 0 N-CA-C 109.15 -1.58 . . . . 40.0 109.15 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.411 ' O ' HG22 ' A' ' 26' ' ' THR . . . 117.44 18.15 5.43 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 119.859 -1.162 . . . . 40.0 111.111 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.645 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -76.58 -170.13 1.44 Allowed 'General case' 0 C--O 1.192 -1.923 0 O-C-N 120.607 -1.525 . . . . 40.0 109.758 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.0 mm -132.84 138.25 52.21 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.024 0 CA-C-O 121.798 0.809 . . . . 40.0 110.257 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -149.92 149.0 29.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.757 -0.589 . . . . 40.0 110.021 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.694 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.59 -17.93 21.86 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.806 -0.559 . . . . 40.0 110.318 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.545 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.9 t30 66.59 27.07 9.68 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.127 -0.983 . . . . 40.0 111.666 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.694 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.0 OUTLIER -55.37 -31.61 61.92 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.2 -1.037 . . . . 40.0 108.2 178.096 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.435 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 21.6 mp0 -64.69 -8.37 14.33 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 108.999 -0.741 . . . . 40.0 108.999 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.15 43.76 98.05 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 110.28 -1.128 . . . . 40.0 110.28 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.654 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -91.8 -13.64 31.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.38 -1.07 . . . . 40.0 109.074 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.545 ' H ' HD21 ' A' ' 58' ' ' ASN . 25.0 mt -135.25 167.43 22.61 Favored Pre-proline 0 N--CA 1.499 1.991 0 N-CA-C 108.299 -1.0 . . . . 40.0 108.299 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.635 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 88.1 Cg_exo -47.21 141.95 12.59 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.595 1.53 . . . . 40.0 112.344 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.649 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.95 -166.9 11.58 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 110.448 -1.061 . . . . 40.0 110.448 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.561 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.8 pttm 172.96 -156.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 106.807 -1.553 . . . . 40.0 106.807 -178.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.43 ' O ' ' OG ' ' A' ' 67' ' ' SER . 57.0 p -75.42 86.44 2.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.656 -1.278 . . . . 40.0 107.901 177.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.561 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.15 99.19 0.31 Allowed Glycine 0 N--CA 1.498 2.802 0 N-CA-C 108.665 -1.774 . . . . 40.0 108.665 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.649 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 17.0 tpp180 -122.56 140.12 53.14 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.349 -1.089 . . . . 40.0 109.878 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.638 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 31.4 p -107.26 131.32 54.33 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 108.212 -1.033 . . . . 40.0 108.212 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.635 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.3 m95 -126.0 141.57 51.9 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.761 -0.776 . . . . 40.0 110.846 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.648 ' HB2' ' CZ ' ' A' ' 90' ' ' TYR . 0.4 OUTLIER -143.8 148.74 36.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.196 -0.94 . . . . 40.0 109.306 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.588 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -113.71 175.48 5.44 Favored 'General case' 0 C--N 1.31 -1.125 0 O-C-N 120.983 -1.073 . . . . 40.0 113.14 -178.715 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.544 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -161.44 139.29 9.18 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.654 -0.654 . . . . 40.0 110.584 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.637 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.17 154.42 39.81 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.5 -0.75 . . . . 40.0 110.232 -179.562 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.562 HG21 ' CE2' ' A' ' 7' ' ' PHE . 18.3 mm -138.11 152.61 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.174 -0.954 . . . . 40.0 109.381 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.514 HD22 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 56.64 56.29 5.68 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.04 0.447 . . . . 40.0 111.505 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.746 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 65.9 t80 -120.51 154.51 35.2 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.936 -1.102 . . . . 40.0 109.129 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.618 ' OG1' ' N ' ' A' ' 80' ' ' SER . 43.5 p -133.32 -79.49 0.48 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 122.036 0.922 . . . . 40.0 109.49 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.618 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.84 103.55 2.78 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 115.314 -0.857 . . . . 40.0 110.027 -179.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.79 -104.58 0.26 Allowed Glycine 0 N--CA 1.501 2.983 0 N-CA-C 108.713 -1.755 . . . . 40.0 108.713 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 15.3 t80 -125.93 -175.46 3.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.534 -0.98 . . . . 40.0 109.429 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.443 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.5 mtm180 -83.68 -149.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.804 . . . . 40.0 109.728 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.442 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.4 p30 -165.02 -134.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.108 -1.071 . . . . 40.0 108.108 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 29.9 p -116.0 -9.18 11.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.773 -1.204 . . . . 40.0 109.978 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.637 ' OD1' HG22 ' A' ' 100' ' ' THR . 23.9 m-20 -74.33 108.77 7.32 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 122.195 -0.316 . . . . 40.0 110.558 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.829 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.07 137.07 42.52 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.114 -0.991 . . . . 40.0 110.422 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.63 HD11 HG21 ' A' ' 96' ' ' ILE . 14.6 tt -106.98 146.51 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 CA-C-O 122.108 0.956 . . . . 40.0 110.858 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.54 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.8 mm? -124.32 129.78 51.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 40.0 108.808 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.648 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 21.8 p90 -132.65 142.03 48.91 Favored 'General case' 0 N--CA 1.515 2.792 0 N-CA-C 109.528 -0.545 . . . . 40.0 109.528 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.585 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.8 p -108.07 -178.71 3.69 Favored 'General case' 0 N--CA 1.506 2.349 0 CA-C-O 122.248 1.023 . . . . 40.0 113.109 -176.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.638 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.12 -52.66 57.96 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.502 1.144 . . . . 40.0 108.45 178.31 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.55 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -67.67 3.72 1.32 Allowed 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.348 -1.297 . . . . 40.0 110.116 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.484 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 73.2 m95 71.55 15.48 6.07 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.823 -0.548 . . . . 40.0 111.789 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 95' ' ' LEU . 21.0 mt -69.38 127.39 32.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.26 -1.525 . . . . 40.0 106.916 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.828 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mp -113.13 135.33 52.98 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 CA-C-O 122.824 1.297 . . . . 40.0 111.347 -177.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.543 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 14.0 m-85 -127.33 159.8 33.3 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.938 -1.504 . . . . 40.0 106.938 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.456 ' NZ ' ' CZ ' ' A' ' 7' ' ' PHE . 4.5 ptmm? -128.45 142.8 50.98 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 119.028 -1.069 . . . . 40.0 112.731 -178.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 131.77 40.84 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 107.616 -1.253 . . . . 40.0 107.616 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.637 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.7 p -116.82 9.52 13.92 Favored 'General case' 0 N--CA 1.51 2.551 0 N-CA-C 109.699 -0.482 . . . . 40.0 109.699 -177.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.617 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -114.72 36.2 3.93 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.496 -0.882 . . . . 40.0 109.341 179.196 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.69 69.32 0.69 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.15 -0.968 . . . . 40.0 110.977 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 58.92 45.87 14.54 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.449 -0.782 . . . . 40.0 110.445 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.617 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 31.5 mm-40 -118.82 -78.73 0.59 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.742 -1.224 . . . . 40.0 109.083 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.521 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.0 p -93.84 121.95 35.82 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 120.849 -1.157 . . . . 40.0 110.183 -178.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.543 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -102.91 84.15 2.33 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.571 -0.706 . . . . 40.0 110.881 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.4 m -77.77 142.29 38.75 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.822 -1.174 . . . . 40.0 108.977 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.543 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 60.7 tttp -75.08 144.93 42.71 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.856 -0.528 . . . . 40.0 110.705 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.652 HD11 HG22 ' A' ' 96' ' ' ILE . 26.9 pt -127.49 -28.86 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 109.166 -0.679 . . . . 40.0 109.166 177.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.658 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.066 0 N-CA-C 108.861 -0.792 . . . . 40.0 108.861 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.685 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.0 t . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.347 -0.612 . . . . 40.0 109.347 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.604 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.7 mt -139.01 146.06 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.373 -0.83 . . . . 40.0 109.709 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.9 p-10 -147.52 32.88 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.089 -1.007 . . . . 40.0 109.765 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -118.87 140.94 49.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.949 0.88 . . . . 40.0 110.287 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.505 ' CE2' HG21 ' A' ' 76' ' ' ILE . 60.0 m-85 -41.17 -85.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 113.033 0.753 . . . . 40.0 113.033 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.642 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -48.37 -45.66 35.94 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.744 -0.598 . . . . 40.0 109.851 -178.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.74 -52.11 31.01 Favored Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.495 -1.042 . . . . 40.0 110.495 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 51.3 t -65.77 -45.08 92.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -1.211 . . . . 40.0 109.726 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 1.051 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.06 -56.98 15.03 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.626 0.727 . . . . 40.0 110.168 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.49 -49.58 67.19 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.965 -0.754 . . . . 40.0 108.965 178.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.633 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 16.6 t80 -51.85 -50.85 60.12 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.179 0.99 . . . . 40.0 109.02 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.56 HD22 ' HZ3' ' A' ' 94' ' ' TRP . 29.3 mt -66.37 -47.16 74.29 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 115.918 -0.583 . . . . 40.0 110.713 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.429 ' HG3' HD11 ' A' ' 96' ' ' ILE . 23.0 mt-30 -64.13 -21.67 66.64 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.196 -0.94 . . . . 40.0 111.531 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.2 m -105.11 -46.02 4.36 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.875 -1.14 . . . . 40.0 111.811 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.577 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.5 m-85 -100.37 -17.12 17.38 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.145 -0.972 . . . . 40.0 110.919 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.5 m-70 61.97 -29.02 0.07 Allowed 'General case' 0 N--CA 1.505 2.3 0 CA-C-O 121.668 0.746 . . . . 40.0 111.282 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.633 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.47 115.96 12.36 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 120.93 -1.106 . . . . 40.0 108.741 179.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.647 HD23 ' HD2' ' A' ' 21' ' ' PRO . 0.9 OUTLIER -42.9 129.92 3.16 Favored Pre-proline 0 N--CA 1.5 2.029 0 N-CA-C 108.846 -0.798 . . . . 40.0 108.846 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.647 ' HD2' HD23 ' A' ' 20' ' ' LEU . 74.2 Cg_exo -35.47 134.82 0.21 Allowed 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.741 2.294 . . . . 40.0 112.94 -179.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.59 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -64.32 73.86 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 121.862 0.839 . . . . 40.0 110.302 -179.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.685 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 172.19 16.34 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.606 -0.684 . . . . 40.0 111.367 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.518 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 12.5 m-85 -113.57 164.64 13.39 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.311 -0.868 . . . . 40.0 111.034 -178.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -153.91 149.94 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.333 -0.855 . . . . 40.0 109.562 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.2 p -70.6 151.38 45.06 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.671 -0.643 . . . . 40.0 109.509 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.659 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -50.58 -51.76 45.35 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 107.715 -1.217 . . . . 40.0 107.715 177.226 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -47.14 -61.85 1.69 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.614 -0.679 . . . . 40.0 110.473 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -49.76 -57.13 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.089 -1.007 . . . . 40.0 108.939 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.93 58.9 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-O 121.632 0.73 . . . . 40.0 109.656 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -64.34 -48.22 76.37 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.829 -0.544 . . . . 40.0 110.985 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.32 -31.08 70.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.259 -0.901 . . . . 40.0 109.957 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.8 -20.11 65.88 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.187 -0.945 . . . . 40.0 108.951 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.564 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 130.99 -1.89 5.5 Favored Glycine 0 N--CA 1.501 2.986 0 N-CA-C 110.863 -0.895 . . . . 40.0 110.863 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -60.07 116.52 4.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.585 -1.538 . . . . 40.0 109.034 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 43.2 t -123.88 143.7 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 CA-C-O 121.735 0.778 . . . . 40.0 110.523 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.8 77.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.244 -0.91 . . . . 40.0 109.812 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.9 p -79.16 51.08 1.13 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.86 -1.15 . . . . 40.0 109.06 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -173.3 -50.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 108.924 -0.769 . . . . 40.0 108.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.39 21.68 72.51 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 108.805 -1.718 . . . . 40.0 108.805 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.564 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -56.79 132.02 51.04 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.85 -0.794 . . . . 40.0 109.059 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.565 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 6.1 tp -169.97 -57.2 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.995 -1.113 . . . . 40.0 107.995 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.22 -23.75 49.96 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.683 -0.636 . . . . 40.0 110.768 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.425 ' OD2' HG13 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -76.86 -64.41 1.13 Allowed 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.709 -0.849 . . . . 40.0 108.709 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.425 HG13 ' OD2' ' A' ' 44' ' ' ASP . 27.5 m -68.87 -27.05 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.534 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -144.62 79.69 12.22 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.571 -0.705 . . . . 40.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -59.26 55.88 0.06 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.713 2.275 . . . . 40.0 114.105 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.95 43.83 0.06 OUTLIER Glycine 0 N--CA 1.502 3.039 0 C-N-CA 120.104 -1.046 . . . . 40.0 111.152 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 19.2 tttt -122.89 146.18 47.8 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.771 -1.429 . . . . 40.0 109.585 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.6 m -116.21 136.97 52.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 40.0 109.808 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.429 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 7.4 mm -66.49 151.86 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 CA-C-O 121.241 0.543 . . . . 40.0 109.606 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 150.41 145.72 4.18 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 118.924 -1.607 . . . . 40.0 110.88 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.77 15.86 3.13 Favored Glycine 0 N--CA 1.494 2.56 0 O-C-N 121.305 -1.115 . . . . 40.0 111.388 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.659 ' CG ' ' HZ2' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -72.11 -169.65 0.52 Allowed 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.151 -1.205 . . . . 40.0 110.356 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.401 HG12 ' C ' ' A' ' 54' ' ' ASP . 1.1 mm -133.49 138.14 51.61 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.62 0 CA-C-O 121.459 0.647 . . . . 40.0 109.627 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -150.41 146.84 26.93 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.426 -0.796 . . . . 40.0 109.63 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.686 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -91.16 -21.83 20.97 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.691 -0.631 . . . . 40.0 110.174 179.737 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.605 HD21 ' H ' ' A' ' 63' ' ' LEU . 64.6 t30 72.33 26.69 2.62 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.265 -0.897 . . . . 40.0 111.588 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.686 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.2 mtm-85 -55.32 -31.86 62.01 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.969 -1.082 . . . . 40.0 108.461 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 20.2 mp0 -62.9 -10.48 13.58 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.063 -0.717 . . . . 40.0 109.063 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.27 45.42 96.51 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 110.402 -1.079 . . . . 40.0 110.402 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.649 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.28 -13.21 25.04 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.579 -0.953 . . . . 40.0 109.741 -179.785 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.615 HD21 ' CD2' ' A' ' 106' ' ' PHE . 24.7 mt -136.77 163.72 47.56 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.15 -1.056 . . . . 40.0 108.15 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.471 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 91.5 Cg_exo -42.62 141.59 2.31 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 122.449 2.099 . . . . 40.0 112.814 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.468 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.97 -171.02 12.71 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 110.788 -0.925 . . . . 40.0 110.788 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.439 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 ptmm? 177.09 -157.77 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.213 -1.403 . . . . 40.0 107.213 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' OG ' ' A' ' 67' ' ' SER . 53.1 p -75.08 84.91 2.32 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 107.134 -1.432 . . . . 40.0 107.134 177.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.439 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.91 99.33 0.35 Allowed Glycine 0 N--CA 1.497 2.726 0 N-CA-C 108.954 -1.658 . . . . 40.0 108.954 -178.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.606 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.1 tpp180 -121.14 142.68 49.64 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.587 -0.949 . . . . 40.0 110.175 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.638 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.99 128.66 55.14 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.341 -0.985 . . . . 40.0 108.341 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.531 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 34.5 m95 -120.54 142.3 49.46 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.062 -1.024 . . . . 40.0 110.814 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.594 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.2 mpp_? -141.22 146.89 37.47 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.462 -0.773 . . . . 40.0 109.986 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.641 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -116.72 169.84 9.05 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 121.184 -0.948 . . . . 40.0 111.983 -179.87 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.518 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -157.49 145.31 18.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.561 -0.712 . . . . 40.0 109.747 178.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.645 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.24 154.63 41.69 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.524 -0.735 . . . . 40.0 109.474 -178.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.505 HG21 ' CE2' ' A' ' 7' ' ' PHE . 15.0 mm -137.34 149.9 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.103 -0.998 . . . . 40.0 109.653 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.471 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.6 m-20 59.69 57.11 3.32 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.144 0.497 . . . . 40.0 111.016 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.565 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 60.6 t80 -121.51 153.83 37.44 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.17 -0.956 . . . . 40.0 109.025 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.61 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.0 p -132.29 -79.81 0.5 Allowed 'General case' 0 N--CA 1.5 2.03 0 CA-C-O 121.833 0.825 . . . . 40.0 109.937 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.61 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.99 99.92 2.59 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 108.723 -0.843 . . . . 40.0 108.723 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.17 -107.71 0.34 Allowed Glycine 0 N--CA 1.496 2.655 0 N-CA-C 109.953 -1.259 . . . . 40.0 109.953 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.471 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 19.5 t80 -123.43 -178.98 4.16 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.343 -1.093 . . . . 40.0 110.299 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.471 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -83.28 -153.45 0.13 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.744 0.783 . . . . 40.0 110.306 -179.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.413 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.7 p30 -162.92 -133.66 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.356 -0.979 . . . . 40.0 108.356 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 100' ' ' THR . 52.9 p -115.39 -10.35 12.01 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.997 -1.064 . . . . 40.0 109.706 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.606 ' OD1' HG22 ' A' ' 100' ' ' THR . 14.1 m-20 -72.57 108.3 5.54 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 120.834 0.35 . . . . 40.0 110.078 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.789 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.02 137.61 41.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.124 -1.03 . . . . 40.0 110.502 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.638 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.6 tt -107.99 148.01 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 122.509 1.147 . . . . 40.0 110.896 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.638 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -125.48 127.3 46.27 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.704 -0.85 . . . . 40.0 108.704 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.594 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.9 p90 -131.48 141.38 49.76 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.682 -0.858 . . . . 40.0 108.682 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.531 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 61.7 p -107.3 178.73 4.46 Favored 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 122.114 0.959 . . . . 40.0 112.155 -177.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.638 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -50.7 -54.04 26.41 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.37 1.081 . . . . 40.0 108.526 177.381 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.606 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -66.02 3.56 0.82 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.694 -1.139 . . . . 40.0 110.389 -179.153 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.56 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 64.9 m95 72.44 13.35 5.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.711 -0.618 . . . . 40.0 111.935 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.47 127.16 31.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 119.896 -1.752 . . . . 40.0 107.428 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 1.051 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mt -114.24 132.8 62.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-O 122.552 1.168 . . . . 40.0 112.529 -177.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.487 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.4 m-85 -125.26 157.08 37.49 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 114.335 -1.302 . . . . 40.0 107.564 178.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.424 ' NZ ' ' CZ ' ' A' ' 7' ' ' PHE . 5.6 ptmm? -128.03 141.54 51.48 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.027 -1.069 . . . . 40.0 112.36 -177.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.423 ' HB ' ' O ' ' A' ' 105' ' ' THR . 0.0 OUTLIER -131.1 132.66 44.99 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 107.128 -1.434 . . . . 40.0 107.128 177.248 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.606 HG22 ' OD1' ' A' ' 86' ' ' ASP . 2.8 p -117.89 9.3 12.83 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 109.449 -0.574 . . . . 40.0 109.449 -178.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.531 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.63 35.11 4.19 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 119.672 -0.811 . . . . 40.0 109.765 179.16 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.13 68.05 0.76 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.21 -0.931 . . . . 40.0 111.036 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 60.53 42.57 14.04 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.793 -0.567 . . . . 40.0 110.778 178.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.531 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.9 mm-40 -114.63 -76.95 0.57 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.732 -1.23 . . . . 40.0 109.655 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.486 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.0 p -93.83 126.03 38.79 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.622 -1.299 . . . . 40.0 110.669 -178.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.615 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.8 m-85 -105.85 85.98 2.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.593 -0.692 . . . . 40.0 110.807 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.5 m -77.89 144.87 36.57 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.25 -0.98 . . . . 40.0 108.793 177.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 58.8 tttp -77.21 147.92 36.15 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.609 -0.682 . . . . 40.0 110.151 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.747 HD11 ' CG2' ' A' ' 96' ' ' ILE . 23.2 pt -127.21 -35.46 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 N-CA-C 108.443 -0.947 . . . . 40.0 108.443 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.642 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.11 0 O-C-N 121.565 -0.709 . . . . 40.0 109.576 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.655 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.3 t . . . . . 0 N--CA 1.494 1.765 0 N-CA-C 109.132 -0.692 . . . . 40.0 109.132 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.571 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 9.5 mt -135.78 147.22 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.473 -0.767 . . . . 40.0 109.599 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -147.73 29.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.99 -1.068 . . . . 40.0 109.734 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.4 p -116.48 143.05 46.07 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 119.68 -0.808 . . . . 40.0 110.732 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.514 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 59.7 m-85 -42.95 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.372 0 N-CA-C 112.781 0.66 . . . . 40.0 112.781 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.622 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.0 OUTLIER -47.59 -47.23 28.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.583 -0.698 . . . . 40.0 110.135 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.24 -50.91 38.4 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.52 -1.032 . . . . 40.0 110.52 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.2 t -65.58 -46.38 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.097 -1.237 . . . . 40.0 109.426 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.994 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.71 -57.1 13.88 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.417 -0.802 . . . . 40.0 110.246 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.08 -51.36 58.13 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 108.904 -0.776 . . . . 40.0 108.904 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.644 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.0 t80 -51.12 -49.93 59.82 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.969 0.89 . . . . 40.0 109.781 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.607 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 34.7 mt -68.25 -45.5 73.03 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.623 -0.673 . . . . 40.0 110.118 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.4 ' HG3' HD11 ' A' ' 96' ' ' ILE . 24.4 mt-30 -65.27 -19.12 65.82 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.387 -0.925 . . . . 40.0 111.744 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.9 m -107.52 -44.01 4.39 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.766 -1.209 . . . . 40.0 110.821 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.594 ' O ' ' N ' ' A' ' 19' ' ' LYS . 83.9 m-85 -104.52 -14.44 15.67 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 40.0 111.615 -177.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.607 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.3 m-70 59.54 -33.44 0.06 Allowed 'General case' 0 N--CA 1.51 2.549 0 CA-C-O 121.288 0.566 . . . . 40.0 111.483 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.644 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -68.68 120.85 15.32 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.758 -1.214 . . . . 40.0 108.233 179.481 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.541 ' HA ' HD21 ' A' ' 14' ' ' LEU . 3.4 mt -48.13 133.02 12.34 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.335 -0.853 . . . . 40.0 109.398 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.458 ' O ' ' N ' ' A' ' 23' ' ' ASN . 78.7 Cg_exo -35.82 132.36 0.29 Allowed 'Trans proline' 0 C--N 1.313 -1.341 0 C-N-CA 122.732 2.288 . . . . 40.0 112.889 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.557 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.3 OUTLIER -63.48 74.8 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.955 0.883 . . . . 40.0 109.732 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.655 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 172.42 15.68 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.655 -0.653 . . . . 40.0 110.577 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -114.93 162.94 16.26 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.747 0.784 . . . . 40.0 111.095 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -149.38 151.4 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.086 -1.009 . . . . 40.0 109.698 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.477 HG22 ' O ' ' A' ' 53' ' ' GLY . 77.7 p -71.57 149.64 45.48 Favored 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 109.049 -0.723 . . . . 40.0 109.049 177.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.623 ' NZ ' ' OD2' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -48.77 -53.67 18.14 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.196 -1.039 . . . . 40.0 108.196 177.812 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.2 t -45.58 -63.19 1.01 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.739 -0.6 . . . . 40.0 110.415 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.436 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 44.5 mt-10 -49.42 -57.12 7.52 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.54 -0.725 . . . . 40.0 109.357 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.01 -48.49 70.38 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.324 -0.86 . . . . 40.0 109.91 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.408 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 57.0 mt-30 -64.43 -48.74 74.18 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 40.0 110.192 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.18 70.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 40.0 110.46 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.68 -20.35 66.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.288 -0.883 . . . . 40.0 109.209 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.566 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 132.73 -4.04 5.04 Favored Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.942 -1.123 . . . . 40.0 111.106 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -61.2 114.39 3.12 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.709 -1.465 . . . . 40.0 109.098 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.7 t -121.93 143.0 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-O 121.799 0.809 . . . . 40.0 110.626 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.08 -47.58 84.03 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.642 -0.661 . . . . 40.0 110.243 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.2 p -79.13 50.15 1.02 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.064 -1.022 . . . . 40.0 108.997 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -174.25 -51.55 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.115 -0.698 . . . . 40.0 109.115 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.63 23.76 75.4 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.566 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.1 p-10 -56.51 130.11 43.64 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.838 -0.801 . . . . 40.0 108.967 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.663 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.4 tp -168.26 -60.05 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.997 -0.742 . . . . 40.0 108.997 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . . . -56.32 -23.64 38.44 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.312 -0.868 . . . . 40.0 109.808 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -65.06 0.98 Allowed 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.916 -0.772 . . . . 40.0 108.916 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.49 -26.76 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-O 121.468 0.652 . . . . 40.0 109.553 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.517 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -144.65 78.64 12.88 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.32 -0.862 . . . . 40.0 109.873 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 43' ' ' ALA . 20.0 Cg_exo -57.49 52.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.497 1.728 0 C-N-CA 122.847 2.364 . . . . 40.0 114.238 -178.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.34 42.92 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 C-N-CA 119.565 -1.302 . . . . 40.0 111.262 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.517 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 10.6 tttt -121.71 144.5 48.75 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.26 . . . . 40.0 109.996 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.0 m -116.25 132.18 56.74 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.177 -0.952 . . . . 40.0 109.941 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.483 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.8 mm -63.89 150.86 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.342 -0.849 . . . . 40.0 110.099 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 152.77 151.61 5.73 Favored Glycine 0 N--CA 1.502 3.048 0 C-N-CA 119.798 -1.191 . . . . 40.0 110.472 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.477 ' O ' HG22 ' A' ' 26' ' ' THR . . . 118.82 18.2 4.83 Favored Glycine 0 N--CA 1.497 2.709 0 O-C-N 121.177 -1.19 . . . . 40.0 110.865 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.623 ' OD2' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -75.78 -169.93 1.2 Allowed 'General case' 0 C--O 1.191 -1.987 0 O-C-N 121.182 -1.187 . . . . 40.0 109.537 179.768 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.8 mm -133.81 142.1 42.29 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.906 0 CA-C-O 121.726 0.774 . . . . 40.0 109.945 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -154.51 146.85 23.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.696 -0.627 . . . . 40.0 109.53 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.685 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -93.39 -19.38 21.37 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.431 -0.793 . . . . 40.0 110.874 -179.762 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.535 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.8 t30 69.15 30.14 4.45 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.115 -0.99 . . . . 40.0 111.825 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.685 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.86 -31.69 65.07 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.966 -1.084 . . . . 40.0 108.43 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.456 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 20.0 mp0 -63.47 -11.54 24.51 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 63.24 41.23 99.64 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.153 -1.179 . . . . 40.0 110.153 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.653 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -91.6 -13.81 31.3 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.446 -1.032 . . . . 40.0 109.157 179.706 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.535 ' H ' HD21 ' A' ' 58' ' ' ASN . 30.8 mt -135.72 163.37 51.01 Favored Pre-proline 0 N--CA 1.494 1.762 0 N-CA-C 108.579 -0.897 . . . . 40.0 108.579 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.631 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 85.4 Cg_exo -43.21 140.11 3.72 Favored 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 121.915 1.744 . . . . 40.0 112.239 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.619 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.16 -165.8 11.4 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.819 -1.312 . . . . 40.0 109.819 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.499 ' HB3' ' NH2' ' A' ' 69' ' ' ARG . 1.4 pttm 171.45 -154.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 107.6 -1.259 . . . . 40.0 107.6 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' A' ' 67' ' ' SER . 17.6 p -74.57 81.91 2.0 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.245 -1.391 . . . . 40.0 107.245 176.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.429 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.85 105.19 0.21 Allowed Glycine 0 N--CA 1.499 2.872 0 N-CA-C 108.762 -1.735 . . . . 40.0 108.762 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.621 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -126.53 141.52 51.84 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.654 -0.909 . . . . 40.0 110.155 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.641 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 27.8 p -108.71 130.13 55.36 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.955 -0.757 . . . . 40.0 108.955 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.631 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 33.5 m95 -121.78 146.24 47.25 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 119.522 -0.871 . . . . 40.0 110.895 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.54 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.8 OUTLIER -147.13 140.77 25.65 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.095 -1.003 . . . . 40.0 109.314 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.604 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -111.85 164.59 12.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.0 -1.062 . . . . 40.0 111.17 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . . . -151.41 147.12 26.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.693 -0.63 . . . . 40.0 109.62 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.639 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.51 155.8 40.23 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.097 -1.002 . . . . 40.0 110.583 -178.503 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.514 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 17.0 mm -139.19 151.81 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.255 -0.903 . . . . 40.0 110.147 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.566 HD22 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 57.96 53.88 6.49 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.311 0.577 . . . . 40.0 111.096 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.663 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 61.5 t80 -118.32 153.78 33.41 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.314 -0.866 . . . . 40.0 108.997 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.9 p -132.8 -79.09 0.49 Allowed 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.739 0.781 . . . . 40.0 109.765 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.26 101.83 2.72 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 109.387 -0.597 . . . . 40.0 109.387 -178.918 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -104.99 0.27 Allowed Glycine 0 N--CA 1.5 2.913 0 N-CA-C 109.643 -1.383 . . . . 40.0 109.643 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.478 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 23.1 t80 -125.85 -178.0 4.13 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.522 -0.987 . . . . 40.0 109.882 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 3.0 mtm180 -83.55 -152.02 0.12 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.43 -0.793 . . . . 40.0 110.456 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.421 HD21 ' HB2' ' A' ' 86' ' ' ASP . 38.4 p-10 -164.01 -132.58 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.686 -0.857 . . . . 40.0 108.686 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 100' ' ' THR . 15.4 p -116.48 -9.63 11.4 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.199 -0.938 . . . . 40.0 109.575 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.65 ' OD1' HG22 ' A' ' 100' ' ' THR . 12.6 m-20 -75.01 108.99 8.1 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-N 116.4 -0.364 . . . . 40.0 110.758 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.824 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.57 140.14 44.42 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.232 -0.917 . . . . 40.0 110.395 179.393 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.662 ' O ' HD22 ' A' ' 89' ' ' LEU . 11.8 tt -108.57 148.98 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-O 122.533 1.159 . . . . 40.0 110.341 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.662 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.9 mm? -126.94 124.65 39.99 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.431 -0.951 . . . . 40.0 108.431 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.3 p90 -128.36 141.38 51.44 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 108.968 -0.753 . . . . 40.0 108.968 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.573 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 59.4 p -107.51 -178.4 3.62 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.083 -1.01 . . . . 40.0 112.017 -176.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.641 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.58 -55.81 22.54 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.403 1.097 . . . . 40.0 108.34 177.464 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.621 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -64.63 5.28 0.31 Allowed 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 114.419 -1.264 . . . . 40.0 110.388 -179.187 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.469 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 66.3 m95 70.46 14.65 7.36 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.74 -0.6 . . . . 40.0 111.856 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 95' ' ' LEU . 26.8 mt -68.42 127.89 34.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 119.66 -1.9 . . . . 40.0 106.719 177.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.994 HD13 ' HB1' ' A' ' 11' ' ' ALA . 3.0 mt -115.96 134.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 CA-C-O 122.803 1.287 . . . . 40.0 111.602 -177.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.429 ' CE1' ' HG2' ' A' ' 64' ' ' PRO . 13.9 m-85 -126.91 157.22 39.98 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.269 -1.382 . . . . 40.0 107.269 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.435 ' NZ ' ' HB2' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.3 144.75 50.99 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 118.929 -1.108 . . . . 40.0 112.39 -178.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.425 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.17 132.68 38.28 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.772 -1.195 . . . . 40.0 107.772 177.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.65 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.2 p -117.87 9.2 12.82 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-O 120.91 0.386 . . . . 40.0 109.973 -177.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.602 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.99 33.18 5.38 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.768 -0.773 . . . . 40.0 109.973 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 63.17 70.13 0.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.975 -1.078 . . . . 40.0 110.362 178.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 56.49 48.33 16.99 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.52 -0.737 . . . . 40.0 109.835 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.602 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 27.3 mm-40 -120.0 -77.71 0.58 Allowed 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.724 -1.235 . . . . 40.0 109.339 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.557 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 17.7 p -94.78 120.58 35.23 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.724 -1.235 . . . . 40.0 110.155 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.512 ' N ' ' CD1' ' A' ' 106' ' ' PHE . 5.7 m-85 -102.28 86.4 2.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.417 -0.802 . . . . 40.0 110.545 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.4 m -79.13 146.9 32.92 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.199 -0.938 . . . . 40.0 109.036 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.503 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 58.0 tttp -78.04 146.87 35.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.796 -0.565 . . . . 40.0 110.41 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.741 HD11 ' CG2' ' A' ' 96' ' ' ILE . 22.4 pt -128.98 -32.0 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 N-CA-C 109.126 -0.694 . . . . 40.0 109.126 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.622 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 108.493 -0.929 . . . . 40.0 108.493 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.687 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.6 t . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.647 -0.501 . . . . 40.0 109.647 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.531 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -137.88 148.93 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.243 -0.911 . . . . 40.0 109.065 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -149.05 34.03 0.74 Allowed 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.209 -0.932 . . . . 40.0 109.798 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 24.4 p -120.09 142.91 48.45 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 119.635 -0.826 . . . . 40.0 110.56 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.584 ' CE2' HG21 ' A' ' 76' ' ' ILE . 68.8 m-85 -43.28 -84.98 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 CA-C-O 121.952 0.882 . . . . 40.0 112.573 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.629 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.6 OUTLIER -45.82 -47.56 15.8 Favored 'General case' 0 C--N 1.283 -2.298 0 O-C-N 121.853 -0.529 . . . . 40.0 110.035 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.62 -49.92 50.96 Favored Glycine 0 N--CA 1.502 3.048 0 N-CA-C 110.331 -1.108 . . . . 40.0 110.331 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -66.17 -43.97 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.224 -1.162 . . . . 40.0 108.562 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.84 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.86 -58.33 8.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.252 -0.905 . . . . 40.0 109.388 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.05 -49.38 63.58 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.368 0.604 . . . . 40.0 109.605 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.612 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.6 t80 -53.67 -48.96 68.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.011 0.91 . . . . 40.0 109.65 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.578 HD21 ' HA ' ' A' ' 20' ' ' LEU . 29.9 mt -69.63 -46.12 66.93 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.805 -0.559 . . . . 40.0 110.658 -178.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -64.72 -22.11 66.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.429 -0.794 . . . . 40.0 110.875 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 m -103.25 -43.89 5.33 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.643 -1.286 . . . . 40.0 111.851 -178.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.558 ' O ' ' N ' ' A' ' 19' ' ' LYS . 86.2 m-85 -107.51 -12.6 15.26 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.168 -0.957 . . . . 40.0 111.005 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.54 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 60.56 -30.9 0.06 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.975 -0.453 . . . . 40.0 111.817 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.612 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -69.69 117.48 11.34 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.936 -1.103 . . . . 40.0 108.583 179.254 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.578 ' HA ' HD21 ' A' ' 14' ' ' LEU . 3.3 mt -44.92 131.75 5.26 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.476 -0.765 . . . . 40.0 109.151 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.509 ' HD2' HD23 ' A' ' 20' ' ' LEU . 71.3 Cg_exo -34.59 132.72 0.17 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.782 2.321 . . . . 40.0 112.549 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.561 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -63.49 74.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.59 0.709 . . . . 40.0 110.479 -179.313 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.687 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 172.37 18.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.578 -0.701 . . . . 40.0 110.681 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -116.57 160.96 19.9 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.52 -0.738 . . . . 40.0 110.978 -178.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.52 152.58 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.249 -0.907 . . . . 40.0 109.151 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.456 HG22 ' O ' ' A' ' 53' ' ' GLY . 72.9 p -71.5 151.01 44.3 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.367 0.603 . . . . 40.0 110.093 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -50.67 -51.75 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.74 -1.207 . . . . 40.0 107.74 177.251 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.9 t -47.13 -62.13 1.56 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.282 -0.886 . . . . 40.0 110.232 178.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -48.53 -58.67 4.33 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.288 -0.883 . . . . 40.0 109.162 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.26 -49.42 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 121.562 0.696 . . . . 40.0 110.067 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -65.07 -50.09 67.49 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.371 0.605 . . . . 40.0 110.32 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.1 -30.36 70.36 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.434 -0.791 . . . . 40.0 110.16 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.9 mt -68.22 -19.69 64.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 40.0 109.215 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.537 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.85 -2.19 5.18 Favored Glycine 0 N--CA 1.5 2.922 0 C-N-CA 119.847 -1.168 . . . . 40.0 111.221 178.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -62.56 113.79 3.17 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.697 -1.472 . . . . 40.0 109.047 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -121.69 144.91 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 40.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.79 85.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.442 -0.786 . . . . 40.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.2 p -79.18 52.17 1.27 Allowed 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.266 -1.013 . . . . 40.0 108.266 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -174.83 -52.26 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 109.261 -0.644 . . . . 40.0 109.261 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.65 22.94 76.88 Favored Glycine 0 N--CA 1.5 2.954 0 N-CA-C 109.38 -1.488 . . . . 40.0 109.38 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.537 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.0 p-10 -59.78 126.51 27.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.58 -0.953 . . . . 40.0 110.304 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.504 HD11 HD11 ' A' ' 51' ' ' ILE . 0.9 OUTLIER -165.53 -57.59 0.03 OUTLIER 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.552 -0.907 . . . . 40.0 108.552 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.463 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . . . -53.93 -29.14 41.04 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.264 -0.897 . . . . 40.0 109.865 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -63.0 1.37 Allowed 'General case' 0 N--CA 1.504 2.228 0 CA-C-O 121.553 0.692 . . . . 40.0 109.732 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.6 m -71.1 -23.76 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.409 -0.807 . . . . 40.0 110.403 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.606 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.78 76.38 9.75 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.153 -0.967 . . . . 40.0 109.461 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 43' ' ' ALA . 2.8 Cg_exo -61.82 57.28 0.12 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.213 1.942 . . . . 40.0 113.097 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 146.62 36.18 0.06 OUTLIER Glycine 0 N--CA 1.504 3.179 0 N-CA-C 110.71 -0.956 . . . . 40.0 110.71 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.606 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 9.4 tttt -118.48 144.14 46.22 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.724 -1.457 . . . . 40.0 109.995 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.8 m -117.02 134.36 54.85 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.217 -0.927 . . . . 40.0 109.314 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.504 HD11 HD11 ' A' ' 42' ' ' LEU . 8.7 mm -65.01 148.41 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 CA-C-O 121.675 0.75 . . . . 40.0 109.719 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.81 145.34 4.12 Favored Glycine 0 N--CA 1.494 2.529 0 C-N-CA 119.002 -1.57 . . . . 40.0 111.151 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.456 ' O ' HG22 ' A' ' 26' ' ' THR . . . 124.14 17.52 3.0 Favored Glycine 0 N--CA 1.494 2.564 0 C-N-CA 119.986 -1.102 . . . . 40.0 111.11 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.565 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -73.33 -166.58 0.34 Allowed 'General case' 0 C--O 1.196 -1.713 0 O-C-N 120.844 -1.386 . . . . 40.0 109.908 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -134.72 140.48 45.5 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.688 0 CA-C-O 121.555 0.693 . . . . 40.0 109.826 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -152.26 146.35 25.35 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.542 -0.724 . . . . 40.0 109.727 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.679 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.23 -18.37 21.75 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.497 -0.752 . . . . 40.0 110.529 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.603 HD21 ' H ' ' A' ' 63' ' ' LEU . 63.3 t30 69.3 29.04 4.67 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.113 -0.992 . . . . 40.0 111.633 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.679 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.45 -30.83 63.35 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.039 -1.038 . . . . 40.0 108.213 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.442 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 24.5 mp0 -64.75 -10.3 26.6 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.369 -0.604 . . . . 40.0 109.369 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.29 44.89 97.03 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.031 -1.228 . . . . 40.0 110.031 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.667 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -94.95 -13.16 25.6 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.603 -0.939 . . . . 40.0 109.249 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.623 HD21 ' CD2' ' A' ' 106' ' ' PHE . 24.3 mt -135.18 164.05 46.63 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 108.378 -0.971 . . . . 40.0 108.378 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.546 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 94.8 Cg_exo -44.08 138.13 6.82 Favored 'Trans proline' 0 N--CA 1.495 1.595 0 C-N-CA 121.83 1.687 . . . . 40.0 112.006 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.608 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.15 -167.4 11.94 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 110.205 -1.158 . . . . 40.0 110.205 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.514 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.2 pttm 173.7 -158.67 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.15 -1.426 . . . . 40.0 107.15 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.46 ' O ' ' OG ' ' A' ' 67' ' ' SER . 32.6 p -73.6 92.29 1.93 Allowed 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.371 -1.344 . . . . 40.0 107.371 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.514 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.1 98.99 0.11 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.116 -1.593 . . . . 40.0 109.116 -178.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.608 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.9 tpp180 -124.49 138.79 54.31 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.7 -0.882 . . . . 40.0 109.587 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.596 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 22.4 p -106.79 130.64 54.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.5 -0.926 . . . . 40.0 108.5 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.573 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 30.6 m95 -122.43 145.49 48.24 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.379 -0.826 . . . . 40.0 110.545 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.552 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.0 OUTLIER -142.95 145.36 32.93 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.289 -0.882 . . . . 40.0 109.583 -179.236 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -114.8 166.44 11.76 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.09 -1.006 . . . . 40.0 111.557 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 88' ' ' ILE . . . -156.02 143.6 19.42 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.275 -0.891 . . . . 40.0 110.371 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.658 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.3 OUTLIER -66.87 153.38 43.62 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.313 -0.867 . . . . 40.0 111.188 -178.79 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.584 HG21 ' CE2' ' A' ' 7' ' ' PHE . 18.7 mm -136.98 153.5 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.393 -0.817 . . . . 40.0 109.799 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.499 HD22 ' CG ' ' A' ' 86' ' ' ASP . 74.8 m-20 56.44 51.62 11.13 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.064 0.459 . . . . 40.0 111.872 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.475 ' CG ' ' N ' ' A' ' 79' ' ' THR . 59.3 t80 -117.39 154.01 32.06 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.126 -0.983 . . . . 40.0 109.323 178.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.65 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.4 p -131.97 -79.61 0.51 Allowed 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.058 0.932 . . . . 40.0 109.424 178.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.65 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -150.89 106.0 3.33 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.773 -0.825 . . . . 40.0 108.773 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 150.76 -107.79 0.36 Allowed Glycine 0 N--CA 1.499 2.883 0 N-CA-C 109.803 -1.319 . . . . 40.0 109.803 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.444 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.7 t80 -125.08 -177.97 4.03 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.345 -1.091 . . . . 40.0 109.376 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.444 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -82.6 -151.74 0.1 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.418 -0.801 . . . . 40.0 110.37 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.452 HD21 ' HB2' ' A' ' 77' ' ' ASN . 36.8 p30 -163.92 -134.21 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.253 -1.017 . . . . 40.0 108.253 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 100' ' ' THR . 53.3 p -116.02 -9.05 11.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.891 -1.131 . . . . 40.0 109.621 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.631 ' OD1' HG22 ' A' ' 100' ' ' THR . 19.7 m-20 -74.45 109.53 8.01 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 120.798 0.333 . . . . 40.0 110.414 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.804 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.45 139.9 44.45 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 119.521 -0.872 . . . . 40.0 109.951 179.31 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.649 ' O ' HD22 ' A' ' 89' ' ' LEU . 18.9 tt -108.79 149.1 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-O 122.403 1.096 . . . . 40.0 110.117 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.649 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.9 mm? -125.74 127.21 45.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.355 -0.841 . . . . 40.0 109.026 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.552 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.0 p90 -129.93 140.65 50.9 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.492 -0.558 . . . . 40.0 109.492 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.573 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.5 p -105.4 -178.07 3.55 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-O 122.27 1.033 . . . . 40.0 112.73 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.596 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -56.2 -50.54 70.95 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-O 122.205 1.003 . . . . 40.0 108.645 178.039 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.539 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -70.25 4.95 1.91 Allowed 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 114.656 -1.157 . . . . 40.0 110.234 -178.85 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.513 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 69.7 m95 72.21 17.4 4.99 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.848 -0.532 . . . . 40.0 111.474 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 95' ' ' LEU . 18.8 mt -72.04 125.83 28.24 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.901 -1.518 . . . . 40.0 106.901 177.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.84 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.4 mp -112.97 133.54 58.48 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 CA-C-O 122.798 1.285 . . . . 40.0 111.975 -177.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.577 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 13.3 m-85 -126.14 158.52 35.31 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.402 -1.333 . . . . 40.0 107.402 178.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.4 ' HD2' ' CG2' ' A' ' 109' ' ' ILE . 6.1 ptmm? -126.79 143.75 51.16 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.642 -1.223 . . . . 40.0 112.462 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.421 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.9 129.62 36.63 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.521 -1.289 . . . . 40.0 107.521 177.494 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.631 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.7 p -115.6 9.47 15.34 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 109.718 -0.475 . . . . 40.0 109.718 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.592 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.1 35.18 4.45 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 119.799 -0.76 . . . . 40.0 109.36 179.183 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.2 68.76 0.74 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.383 -0.823 . . . . 40.0 111.168 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 62.07 40.37 12.12 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.47 -0.769 . . . . 40.0 110.657 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.592 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.2 mm-40 -114.39 -76.14 0.58 Allowed 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.749 -1.219 . . . . 40.0 110.002 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.546 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 27.5 p -95.13 124.0 38.93 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.706 -1.246 . . . . 40.0 110.068 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.623 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.7 m-85 -104.44 84.71 2.23 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.475 -0.765 . . . . 40.0 110.891 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.35 145.42 35.26 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.954 -1.091 . . . . 40.0 108.948 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.577 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 59.1 tttp -76.84 143.72 39.54 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.972 -0.455 . . . . 40.0 110.193 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.729 HD11 HG22 ' A' ' 96' ' ' ILE . 36.8 pt -127.45 -31.4 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 109.446 -0.576 . . . . 40.0 109.446 178.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.629 HH22 ' CG ' ' A' ' 8' ' ' ASP . 1.4 mmt-85 . . . . . 0 N--CA 1.504 2.241 0 N-CA-C 109.157 -0.683 . . . . 40.0 109.157 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.704 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.1 t . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 121.003 0.43 . . . . 40.0 109.983 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.574 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.0 mt -138.02 148.62 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.288 -0.883 . . . . 40.0 109.824 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -149.24 32.62 0.74 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.265 -0.897 . . . . 40.0 109.515 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 37.9 p -118.65 139.23 51.85 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.782 0.801 . . . . 40.0 110.314 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.507 ' CE2' HG21 ' A' ' 76' ' ' ILE . 55.9 m-85 -40.62 -87.95 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 122.291 1.043 . . . . 40.0 113.367 -178.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.661 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.5 OUTLIER -44.13 -48.78 9.13 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 115.734 -0.666 . . . . 40.0 109.877 -179.042 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.48 -50.49 41.54 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 110.298 -1.121 . . . . 40.0 110.298 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.7 t -65.42 -46.32 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.019 -1.283 . . . . 40.0 109.099 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 1.027 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -55.17 -57.89 9.9 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.573 0.701 . . . . 40.0 110.119 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.21 -49.72 63.34 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.681 -0.637 . . . . 40.0 109.672 178.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.592 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 18.5 t80 -51.65 -50.17 60.87 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.312 1.053 . . . . 40.0 108.605 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.634 HD21 ' HA ' ' A' ' 20' ' ' LEU . 25.6 mt -69.28 -45.12 70.41 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.592 -0.731 . . . . 40.0 111.006 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.402 ' HG3' HD11 ' A' ' 96' ' ' ILE . 16.8 mt-30 -65.08 -21.61 66.84 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 40.0 110.926 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.9 m -103.09 -44.7 5.14 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.015 -1.053 . . . . 40.0 111.56 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.574 ' C ' ' H ' ' A' ' 19' ' ' LYS . 88.9 m-85 -105.53 -13.63 15.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.129 -0.982 . . . . 40.0 111.42 -177.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.573 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 59.77 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 121.303 0.573 . . . . 40.0 111.759 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.592 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.65 117.92 14.93 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 120.494 -1.379 . . . . 40.0 108.886 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.634 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -45.84 128.44 6.89 Favored Pre-proline 0 C--N 1.296 -1.74 0 O-C-N 121.328 -0.858 . . . . 40.0 109.461 -179.571 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.55 ' HD2' HD23 ' A' ' 20' ' ' LEU . 75.1 Cg_exo -34.11 133.31 0.14 Allowed 'Trans proline' 0 N--CA 1.489 1.251 0 C-N-CA 122.976 2.451 . . . . 40.0 112.988 -179.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.575 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -64.78 75.75 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.806 0.812 . . . . 40.0 110.791 -178.827 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.704 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 171.83 16.05 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.862 -0.523 . . . . 40.0 110.919 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.498 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 13.4 m-85 -113.06 167.42 10.54 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.432 -0.793 . . . . 40.0 111.353 -179.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -158.16 150.89 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.067 -1.021 . . . . 40.0 108.801 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.3 p -69.7 154.23 42.27 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.384 0.611 . . . . 40.0 109.548 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.643 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -53.29 -50.72 64.3 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.148 -1.427 . . . . 40.0 107.148 176.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -47.65 -62.13 1.6 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.51 -0.744 . . . . 40.0 110.544 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -49.05 -57.61 6.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.347 -0.845 . . . . 40.0 109.172 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.9 -49.99 61.92 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.581 -0.699 . . . . 40.0 109.71 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.405 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 51.4 mt-30 -64.05 -50.07 69.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.689 -0.632 . . . . 40.0 110.762 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.89 -32.79 74.28 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.429 -0.794 . . . . 40.0 109.953 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mt -64.89 -20.68 66.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.268 -0.895 . . . . 40.0 109.334 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.548 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.49 -2.02 5.31 Favored Glycine 0 N--CA 1.498 2.767 0 N-CA-C 110.668 -0.973 . . . . 40.0 110.668 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -59.97 114.01 2.6 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.73 -1.453 . . . . 40.0 109.299 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.27 143.44 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 CA-C-O 121.926 0.869 . . . . 40.0 111.168 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.3 78.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.797 -0.564 . . . . 40.0 110.392 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.5 p -79.32 52.08 1.3 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.016 -1.053 . . . . 40.0 108.452 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -175.49 -52.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.095 -0.706 . . . . 40.0 109.095 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.22 18.14 76.43 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.548 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -52.96 130.35 33.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.943 -0.739 . . . . 40.0 109.905 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.637 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 3.7 tp -169.34 -57.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.517 -0.92 . . . . 40.0 108.517 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.68 -25.36 53.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.231 -0.918 . . . . 40.0 109.934 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.87 -60.05 2.53 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.122 -0.695 . . . . 40.0 109.122 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.2 m -74.27 -22.46 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.527 -0.733 . . . . 40.0 109.64 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.613 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.77 78.78 8.88 Favored Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 40.0 109.339 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -56.24 50.55 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 123.311 2.674 . . . . 40.0 113.998 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.547 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.17 0.06 OUTLIER Glycine 0 N--CA 1.504 3.175 0 C-N-CA 119.911 -1.138 . . . . 40.0 111.047 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.613 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 18.6 tttt -120.14 145.59 46.79 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 120.906 -1.349 . . . . 40.0 109.662 179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 14.8 m -116.61 136.3 53.09 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.306 -0.871 . . . . 40.0 109.642 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.508 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.9 mm -69.63 153.79 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.866 . . . . 40.0 110.223 -179.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.77 143.98 3.83 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 119.048 -1.548 . . . . 40.0 110.401 179.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 128.88 13.2 2.5 Favored Glycine 0 N--CA 1.496 2.636 0 C-N-CA 119.495 -1.336 . . . . 40.0 111.217 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.617 ' CG ' ' HZ1' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -73.99 -172.83 1.43 Allowed 'General case' 0 C--O 1.195 -1.804 0 O-C-N 120.904 -1.35 . . . . 40.0 110.84 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.48 143.74 40.06 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 CA-C-O 121.701 0.762 . . . . 40.0 110.173 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -155.94 147.2 22.53 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.31 -0.868 . . . . 40.0 109.54 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.717 ' HG ' HH12 ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.19 -16.6 24.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.739 -0.601 . . . . 40.0 110.636 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.9 t30 66.19 28.09 10.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.17 -0.956 . . . . 40.0 111.72 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.717 HH12 ' HG ' ' A' ' 57' ' ' SER . 1.1 mtm-85 -56.45 -31.06 63.62 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.023 -1.048 . . . . 40.0 108.384 178.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 17.4 mp0 -61.93 -12.1 16.46 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.903 -0.777 . . . . 40.0 108.903 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.55 40.44 99.13 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 110.003 -1.239 . . . . 40.0 110.003 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.581 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -93.99 -10.51 33.37 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.828 -0.807 . . . . 40.0 109.23 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.521 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 36.9 mt -135.62 162.64 55.92 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 108.032 -1.099 . . . . 40.0 108.032 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.647 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 97.3 Cg_exo -44.79 139.52 7.54 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 121.536 1.491 . . . . 40.0 112.298 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.497 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.94 -169.58 12.49 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 110.361 -1.096 . . . . 40.0 110.361 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.472 ' HB3' ' NH2' ' A' ' 69' ' ' ARG . 3.4 pttm 175.35 -156.66 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.924 -1.51 . . . . 40.0 106.924 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.428 ' O ' ' OG ' ' A' ' 67' ' ' SER . 59.5 p -74.41 84.54 1.97 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.546 -1.279 . . . . 40.0 107.546 178.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.42 102.82 0.2 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 108.417 -1.873 . . . . 40.0 108.417 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.566 HH11 ' CG ' ' A' ' 93' ' ' ASP . 15.6 tpp180 -125.51 141.55 51.98 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.869 -0.783 . . . . 40.0 109.55 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.624 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 25.5 p -108.88 131.31 55.13 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.741 -0.837 . . . . 40.0 108.741 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.647 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.2 m95 -121.91 147.97 45.34 Favored 'General case' 0 N--CA 1.5 2.047 0 C-N-CA 119.453 -0.899 . . . . 40.0 111.014 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.589 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.3 mpp_? -146.02 144.72 30.26 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.183 -0.948 . . . . 40.0 109.676 -178.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.643 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.09 165.55 13.01 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.146 -0.971 . . . . 40.0 111.515 179.558 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.498 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -152.16 147.5 26.5 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.504 -0.748 . . . . 40.0 109.574 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.685 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -71.38 150.77 44.71 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.592 -0.693 . . . . 40.0 110.244 -179.061 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.507 HG21 ' CE2' ' A' ' 7' ' ' PHE . 15.5 mm -134.66 150.59 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 40.0 109.916 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.528 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.7 m-20 58.26 60.15 2.76 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-O 121.235 0.541 . . . . 40.0 111.485 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.637 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 66.2 t80 -123.87 154.28 39.89 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.103 -0.998 . . . . 40.0 109.385 178.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.602 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.0 p -132.19 -80.38 0.5 Allowed 'General case' 0 N--CA 1.502 2.154 0 CA-C-O 121.719 0.771 . . . . 40.0 110.005 179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.602 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.16 102.01 2.75 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 109.167 -0.679 . . . . 40.0 109.167 -179.107 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.88 -104.32 0.26 Allowed Glycine 0 N--CA 1.5 2.965 0 N-CA-C 109.833 -1.307 . . . . 40.0 109.833 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.451 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.8 t80 -125.79 -178.42 4.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.47 -1.018 . . . . 40.0 109.934 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.456 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.7 mtm180 -83.86 -151.88 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.655 -0.653 . . . . 40.0 110.425 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.511 HD21 ' HB2' ' A' ' 86' ' ' ASP . 47.7 p-10 -164.7 -136.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.851 -0.796 . . . . 40.0 108.851 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.459 ' OG ' ' O ' ' A' ' 100' ' ' THR . 22.4 p -113.13 -11.85 13.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.993 -1.067 . . . . 40.0 109.871 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.572 ' OD1' HG22 ' A' ' 100' ' ' THR . 11.8 m-20 -71.79 109.17 5.49 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 120.964 0.412 . . . . 40.0 110.518 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.831 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.85 140.55 44.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.533 -0.729 . . . . 40.0 110.025 179.657 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.695 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.9 tt -111.23 149.93 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 CA-C-O 122.375 1.084 . . . . 40.0 109.757 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.695 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -127.18 127.54 44.67 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 109.326 -0.62 . . . . 40.0 109.326 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.589 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.6 p90 -131.65 141.76 49.69 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 109.116 -0.698 . . . . 40.0 109.116 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.536 ' HB3' ' CE2' ' A' ' 71' ' ' TRP . 64.3 p -107.61 -179.86 4.03 Favored 'General case' 0 N--CA 1.505 2.287 0 CA-C-O 122.22 1.01 . . . . 40.0 112.418 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.624 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.77 -50.54 63.34 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 122.35 1.072 . . . . 40.0 108.636 178.508 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.566 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 3.83 1.84 Allowed 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.598 -1.183 . . . . 40.0 110.241 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.535 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 78.5 m95 72.53 13.59 5.36 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.764 -0.585 . . . . 40.0 111.758 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 95' ' ' LEU . 21.1 mt -70.01 128.9 37.94 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.819 -1.8 . . . . 40.0 107.562 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 1.027 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mt -114.59 135.54 54.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 CA-C-O 122.707 1.241 . . . . 40.0 112.527 -176.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.559 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.8 m-85 -127.75 156.49 42.35 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.377 -1.342 . . . . 40.0 107.377 179.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.464 ' NZ ' ' HB2' ' A' ' 98' ' ' LYS . 4.7 ptmm? -125.31 143.64 50.87 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 118.758 -1.177 . . . . 40.0 112.73 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.408 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -134.84 132.09 38.19 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.233 -1.395 . . . . 40.0 107.233 177.722 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.572 HG22 ' OD1' ' A' ' 86' ' ' ASP . 4.0 p -117.9 11.56 13.51 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 109.566 -0.531 . . . . 40.0 109.566 -177.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.604 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -116.32 32.97 5.8 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.902 -0.719 . . . . 40.0 109.798 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 64.37 66.62 0.61 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.012 -1.055 . . . . 40.0 111.03 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 60.76 43.2 12.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.266 -0.896 . . . . 40.0 110.472 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.604 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.6 mm-40 -116.37 -76.81 0.57 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.621 -1.299 . . . . 40.0 109.104 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.544 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.9 p -94.25 122.27 36.61 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.67 -1.269 . . . . 40.0 109.785 -178.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.55 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 4.9 m-85 -104.11 84.73 2.27 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.54 -0.725 . . . . 40.0 110.972 -179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 m -77.9 144.51 36.84 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.916 -1.115 . . . . 40.0 109.314 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.572 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 60.5 tttp -75.83 147.72 38.93 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.41 -0.806 . . . . 40.0 110.592 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.81 HD11 HG22 ' A' ' 96' ' ' ILE . 38.8 pt -129.81 -31.14 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 109.223 -0.658 . . . . 40.0 109.223 178.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.661 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.15 0 CA-C-O 118.514 -0.755 . . . . 40.0 109.097 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.678 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 109.917 -0.401 . . . . 40.0 109.917 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.582 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.7 mt -140.13 147.79 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 40.0 109.068 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -149.98 35.03 0.67 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.072 -1.017 . . . . 40.0 109.454 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.6 p -119.76 144.07 47.47 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 119.577 -0.849 . . . . 40.0 110.512 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.507 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 62.0 m-85 -45.23 -85.56 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 N-CA-C 113.471 0.915 . . . . 40.0 113.471 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.642 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.14 -46.26 17.08 Favored 'General case' 0 C--N 1.288 -2.071 0 O-C-N 121.623 -0.673 . . . . 40.0 110.117 -179.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.03 60.45 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.732 -0.947 . . . . 40.0 110.732 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.6 t -66.84 -42.11 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.019 -1.283 . . . . 40.0 108.29 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.909 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -60.51 -55.4 33.88 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.961 -1.087 . . . . 40.0 109.585 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.23 -50.24 62.37 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.478 -0.764 . . . . 40.0 109.186 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.607 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 19.2 t80 -52.78 -49.54 65.37 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.72 0.772 . . . . 40.0 109.81 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.647 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.6 mt -68.6 -45.8 71.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.596 -0.69 . . . . 40.0 109.855 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -64.05 -23.02 67.17 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.6 -1.24 . . . . 40.0 110.625 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.2 m -105.41 -41.76 5.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.66 -1.275 . . . . 40.0 111.66 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.601 ' O ' ' N ' ' A' ' 19' ' ' LYS . 79.2 m-85 -103.46 -16.08 15.69 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.762 -1.211 . . . . 40.0 110.846 -177.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.647 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.45 -36.64 0.11 Allowed 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 121.546 0.688 . . . . 40.0 110.662 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.607 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -66.86 118.72 10.75 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 120.83 -1.168 . . . . 40.0 108.265 179.06 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.503 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -45.51 132.93 6.19 Favored Pre-proline 0 N--CA 1.499 2.02 0 O-C-N 121.366 -0.834 . . . . 40.0 108.923 -179.222 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.479 ' O ' ' N ' ' A' ' 23' ' ' ASN . 62.6 Cg_exo -35.31 134.14 0.2 Allowed 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 122.246 1.964 . . . . 40.0 112.557 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.75 73.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.695 0.759 . . . . 40.0 110.067 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.678 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.0 p-10 174.05 19.23 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.763 -0.585 . . . . 40.0 111.197 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.515 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 13.4 m-85 -118.04 162.04 18.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.489 0.662 . . . . 40.0 111.542 -178.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -150.64 152.43 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.275 -0.891 . . . . 40.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 53' ' ' GLY . 76.2 p -72.4 151.7 42.46 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.532 -0.73 . . . . 40.0 109.407 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.646 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -48.7 -53.66 17.94 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.121 -1.066 . . . . 40.0 108.121 177.517 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.5 t -46.19 -63.42 0.99 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.547 -0.721 . . . . 40.0 110.312 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -48.27 -58.4 4.61 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.202 -0.937 . . . . 40.0 108.962 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.72 -49.41 62.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.353 -0.842 . . . . 40.0 110.228 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.441 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 55.6 mt-30 -64.99 -48.97 72.07 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.44 -0.787 . . . . 40.0 110.255 -178.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.28 -31.85 72.9 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.576 -0.703 . . . . 40.0 110.985 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mt -67.68 -19.3 65.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.498 -0.751 . . . . 40.0 109.075 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.5 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.14 0.4 5.1 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 119.945 -1.121 . . . . 40.0 111.358 178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -62.61 114.08 3.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.595 -1.532 . . . . 40.0 108.603 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.3 t -122.11 140.92 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.548 0 CA-C-O 121.891 0.853 . . . . 40.0 110.377 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.51 -47.02 85.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.44 -0.787 . . . . 40.0 109.886 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.6 p -77.74 50.42 0.84 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.886 -1.134 . . . . 40.0 109.063 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -175.79 -48.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.137 0.494 . . . . 40.0 109.767 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.5 72.76 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 108.912 -1.675 . . . . 40.0 108.912 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.5 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.3 p-10 -56.04 130.76 45.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.798 -0.825 . . . . 40.0 109.326 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.602 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.0 tp -170.1 -58.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.66 -0.867 . . . . 40.0 108.66 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.54 -25.48 52.09 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.388 -0.82 . . . . 40.0 109.673 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.435 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -75.63 -65.22 0.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.0 -0.741 . . . . 40.0 109.0 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.2 m -67.14 -29.83 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.428 -0.795 . . . . 40.0 109.753 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -140.46 77.71 23.19 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.746 -0.596 . . . . 40.0 110.227 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.83 50.02 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 123.276 2.65 . . . . 40.0 113.829 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.18 43.83 0.04 OUTLIER Glycine 0 N--CA 1.497 2.733 0 C-N-CA 119.556 -1.307 . . . . 40.0 111.375 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.556 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 10.2 tttt -121.75 145.04 48.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.874 -1.368 . . . . 40.0 109.436 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 m -119.26 133.74 55.59 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.797 -1.189 . . . . 40.0 110.455 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.8 mm -65.49 153.48 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.19 -0.944 . . . . 40.0 110.216 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.502 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.37 145.63 4.17 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.525 -1.43 . . . . 40.0 109.525 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.427 ' O ' HG22 ' A' ' 26' ' ' THR . . . 125.42 15.4 3.03 Favored Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.877 -1.154 . . . . 40.0 111.181 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.533 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -74.81 -166.86 0.5 Allowed 'General case' 0 C--O 1.194 -1.863 0 O-C-N 120.576 -1.544 . . . . 40.0 110.332 -179.077 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.5 mm -134.54 139.57 47.52 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.706 0 CA-C-O 121.6 0.714 . . . . 40.0 109.581 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -151.62 146.99 26.22 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.894 -0.78 . . . . 40.0 108.894 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.683 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -94.16 -18.06 22.12 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 40.0 109.672 -179.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.496 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.6 t30 68.71 30.24 4.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.359 -0.838 . . . . 40.0 111.917 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.683 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 0.9 OUTLIER -57.92 -29.98 65.55 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.904 -1.122 . . . . 40.0 108.134 178.534 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.442 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 20.9 mp0 -64.35 -11.38 31.83 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.324 0.583 . . . . 40.0 109.462 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.2 44.5 98.04 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 110.339 -1.104 . . . . 40.0 110.339 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.599 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.48 -12.74 25.36 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.566 -0.961 . . . . 40.0 108.828 179.849 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.671 HD21 ' CD2' ' A' ' 106' ' ' PHE . 52.3 mt -136.8 162.17 57.49 Favored Pre-proline 0 N--CA 1.497 1.912 0 N-CA-C 108.318 -0.993 . . . . 40.0 108.318 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.492 ' O ' ' NE1' ' A' ' 71' ' ' TRP . 86.6 Cg_exo -43.75 142.36 3.47 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 122.103 1.869 . . . . 40.0 112.667 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.624 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.77 -165.94 11.35 Favored Glycine 0 N--CA 1.492 2.429 0 C-N-CA 120.018 -1.087 . . . . 40.0 110.915 -178.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.471 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.3 pttm 173.5 -157.79 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 107.775 -1.194 . . . . 40.0 107.775 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.481 ' O ' ' OG ' ' A' ' 67' ' ' SER . 51.6 p -73.54 86.23 1.57 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 106.983 -1.488 . . . . 40.0 106.983 177.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.471 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.91 99.59 0.23 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.295 -1.522 . . . . 40.0 109.295 -178.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.624 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 18.5 tpp180 -121.85 140.84 51.89 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.388 -1.066 . . . . 40.0 110.031 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.6 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 24.8 p -109.4 130.83 55.48 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 108.123 -1.066 . . . . 40.0 108.123 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.503 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 33.8 m95 -121.82 143.69 49.26 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.324 -0.86 . . . . 40.0 111.16 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.579 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.1 mpp_? -141.61 147.5 37.73 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.453 -0.779 . . . . 40.0 109.692 -178.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.646 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -119.24 169.82 9.64 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 119.551 -0.86 . . . . 40.0 112.058 179.897 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.515 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -157.34 145.27 19.05 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.521 -0.737 . . . . 40.0 110.272 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.642 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -69.36 151.93 45.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.667 -0.645 . . . . 40.0 110.292 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.507 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 14.5 mm -135.95 152.65 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.178 -0.951 . . . . 40.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.532 HD22 ' CG ' ' A' ' 86' ' ' ASP . 75.1 m-20 57.94 51.15 9.3 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.01 0.433 . . . . 40.0 111.507 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.602 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 57.1 t80 -116.85 153.13 33.05 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.972 -1.08 . . . . 40.0 109.217 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.604 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.7 p -132.8 -77.55 0.49 Allowed 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.854 0.835 . . . . 40.0 109.608 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.604 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.58 102.28 2.71 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 109.442 -0.577 . . . . 40.0 109.442 -179.392 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 153.09 -104.27 0.25 Allowed Glycine 0 N--CA 1.499 2.874 0 N-CA-C 109.841 -1.304 . . . . 40.0 109.841 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 11.8 t80 -126.03 -179.41 4.69 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.681 -0.894 . . . . 40.0 109.91 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.46 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.3 mtm180 -80.96 -150.87 0.08 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 121.581 0.705 . . . . 40.0 110.049 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.461 HD21 ' HB2' ' A' ' 77' ' ' ASN . 27.3 p30 -164.3 -136.62 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.182 -1.044 . . . . 40.0 108.182 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.467 ' OG ' ' O ' ' A' ' 100' ' ' THR . 50.6 p -114.04 -9.12 13.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.808 -1.183 . . . . 40.0 109.192 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.665 ' OD1' HG22 ' A' ' 100' ' ' THR . 18.3 m-20 -73.69 109.36 7.14 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.287 -0.415 . . . . 40.0 110.394 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.83 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.12 137.25 40.81 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.369 -0.832 . . . . 40.0 110.258 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.544 ' O ' HD22 ' A' ' 89' ' ' LEU . 15.2 tt -108.39 145.88 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 122.61 1.195 . . . . 40.0 110.592 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.0 mm? -123.1 127.23 48.44 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.841 -0.8 . . . . 40.0 108.841 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.579 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.0 p90 -132.05 140.72 48.98 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.746 -0.835 . . . . 40.0 108.746 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.503 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.6 p -107.23 178.46 4.54 Favored 'General case' 0 N--CA 1.51 2.56 0 CA-C-O 122.511 1.148 . . . . 40.0 112.662 -176.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.6 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -49.77 -54.97 15.84 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.569 1.176 . . . . 40.0 108.353 177.164 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.624 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -67.75 6.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.51 -1.223 . . . . 40.0 111.098 -178.848 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.452 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 67.4 m95 70.76 15.22 6.97 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.807 -0.558 . . . . 40.0 112.172 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.9 mt -70.37 127.14 31.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.169 -1.582 . . . . 40.0 106.819 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.909 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.3 mp -113.92 135.21 54.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-O 123.004 1.383 . . . . 40.0 112.224 -177.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.628 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.0 m-85 -128.43 158.17 39.06 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.577 -1.268 . . . . 40.0 107.577 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.448 ' NZ ' ' HB2' ' A' ' 98' ' ' LYS . 5.9 ptmm? -126.69 145.97 50.38 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.714 -1.195 . . . . 40.0 112.566 -178.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.423 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.93 130.58 33.94 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.282 -1.377 . . . . 40.0 107.282 177.31 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.665 HG22 ' OD1' ' A' ' 86' ' ' ASP . 2.4 p -116.13 11.07 15.14 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.234 -0.654 . . . . 40.0 109.234 -177.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.589 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -117.29 34.71 4.99 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.723 -0.791 . . . . 40.0 109.498 178.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.8 68.33 0.7 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.431 -0.793 . . . . 40.0 111.02 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 60.1 43.85 13.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.429 -0.795 . . . . 40.0 110.279 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.589 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 28.7 mm-40 -116.47 -77.89 0.57 Allowed 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.833 -1.167 . . . . 40.0 108.66 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.514 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.4 p -94.25 120.21 34.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.737 -1.227 . . . . 40.0 110.642 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.671 ' CD2' HD21 ' A' ' 63' ' ' LEU . 10.0 m-85 -101.01 82.73 2.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.342 -0.848 . . . . 40.0 111.589 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.2 m -75.54 142.1 42.86 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.038 -1.038 . . . . 40.0 109.372 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.628 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 61.4 tttp -76.45 148.87 36.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.539 -0.726 . . . . 40.0 110.452 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.678 HD11 HG22 ' A' ' 96' ' ' ILE . 32.7 pt -131.4 -30.13 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 109.144 -0.687 . . . . 40.0 109.144 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.642 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.903 0 CA-C-O 118.394 -0.812 . . . . 40.0 109.088 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.684 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.5 t . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.176 -0.676 . . . . 40.0 109.176 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.563 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.05 150.34 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.468 -0.77 . . . . 40.0 108.992 -179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -150.06 35.15 0.66 Allowed 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.159 -0.963 . . . . 40.0 109.397 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.4 p -119.27 141.58 48.83 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.924 -0.71 . . . . 40.0 110.331 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.489 ' CE2' HG21 ' A' ' 76' ' ' ILE . 69.7 m-85 -43.54 -84.39 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.024 0.916 . . . . 40.0 112.904 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.6 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.97 -47.09 21.92 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 121.724 -0.61 . . . . 40.0 110.08 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.05 -48.53 62.66 Favored Glycine 0 N--CA 1.502 3.046 0 N-CA-C 110.497 -1.041 . . . . 40.0 110.497 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -44.11 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.4 . . . . 40.0 108.452 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.724 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -57.81 -58.04 10.11 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.607 -0.683 . . . . 40.0 110.12 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -51.11 61.35 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.693 -0.855 . . . . 40.0 108.693 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.616 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.9 t80 -50.35 -50.21 51.78 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.931 0.872 . . . . 40.0 109.671 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.614 HD21 ' HA ' ' A' ' 20' ' ' LEU . 24.4 mt -69.69 -45.17 68.9 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.543 -0.723 . . . . 40.0 110.481 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -63.53 -20.89 66.0 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 119.411 -0.915 . . . . 40.0 111.417 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.1 m -105.73 -45.02 4.51 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.692 -1.255 . . . . 40.0 111.463 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.573 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.6 m-85 -102.9 -15.07 16.29 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.351 -0.843 . . . . 40.0 110.913 -177.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.561 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-70 60.6 -30.5 0.06 Allowed 'General case' 0 N--CA 1.505 2.322 0 CA-C-O 121.447 0.641 . . . . 40.0 111.045 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.616 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -69.72 117.99 12.02 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.695 -1.253 . . . . 40.0 108.792 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.614 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -46.5 132.17 7.98 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.47 -0.769 . . . . 40.0 109.427 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.476 ' HD2' HD23 ' A' ' 20' ' ' LEU . 67.7 Cg_exo -36.59 133.66 0.35 Allowed 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.866 2.377 . . . . 40.0 112.5 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.566 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -64.67 75.62 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.011 0.91 . . . . 40.0 110.433 -179.174 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.684 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 174.0 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.733 -0.605 . . . . 40.0 110.406 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 50' ' ' SER . 18.1 m-85 -114.52 163.96 14.65 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.426 -0.796 . . . . 40.0 111.396 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.98 152.06 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.45 -0.781 . . . . 40.0 109.417 178.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 53' ' ' GLY . 61.2 p -72.39 150.75 43.13 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 108.909 -0.774 . . . . 40.0 108.909 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.632 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -49.98 -52.19 35.67 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.529 -0.915 . . . . 40.0 108.529 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -46.74 -61.58 1.78 Allowed 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.446 -0.784 . . . . 40.0 110.268 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.413 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 41.8 mt-10 -50.76 -56.64 11.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.153 -0.967 . . . . 40.0 109.234 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.97 -49.02 66.96 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.459 -0.776 . . . . 40.0 109.739 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.4 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 50.2 mt-30 -65.65 -49.22 69.43 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.751 -0.593 . . . . 40.0 110.291 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.68 -31.04 70.74 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.399 -0.813 . . . . 40.0 110.351 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.38 -18.85 65.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.134 -0.979 . . . . 40.0 109.267 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.562 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 133.04 -4.2 4.95 Favored Glycine 0 N--CA 1.497 2.719 0 C-N-CA 119.871 -1.157 . . . . 40.0 111.087 178.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -62.02 116.04 4.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.544 -1.562 . . . . 40.0 108.746 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 31.0 t -124.12 142.6 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 121.87 0.843 . . . . 40.0 110.506 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.06 83.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.353 -0.842 . . . . 40.0 110.561 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 p -77.68 48.17 0.66 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.825 -1.172 . . . . 40.0 109.318 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -173.58 -50.3 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.572 -0.705 . . . . 40.0 109.328 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.18 24.59 76.5 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 108.974 -1.651 . . . . 40.0 108.974 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.562 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -58.77 130.83 48.8 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.748 -0.854 . . . . 40.0 109.42 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.526 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.2 tp -170.77 -56.69 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.295 -1.002 . . . . 40.0 108.295 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.09 -23.27 32.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 40.0 109.906 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.79 -66.28 0.88 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.899 -0.778 . . . . 40.0 108.899 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 24.5 m -67.32 -26.98 37.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 109.079 -0.712 . . . . 40.0 109.079 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.661 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -142.5 77.97 16.77 Favored Pre-proline 0 N--CA 1.488 1.443 0 O-C-N 121.411 -0.806 . . . . 40.0 109.982 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.95 50.01 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.972 2.448 . . . . 40.0 113.966 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.44 42.22 0.05 OUTLIER Glycine 0 N--CA 1.5 2.942 0 C-N-CA 119.766 -1.207 . . . . 40.0 111.338 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.661 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 13.4 tttt -119.83 147.69 44.36 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.906 -1.349 . . . . 40.0 110.035 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.458 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 13.1 m -117.6 134.1 55.24 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.155 -0.965 . . . . 40.0 109.994 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.482 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.3 mm -67.47 154.89 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.921 -1.112 . . . . 40.0 110.589 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.444 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.63 150.62 5.29 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.491 -1.338 . . . . 40.0 110.049 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.434 ' O ' HG22 ' A' ' 26' ' ' THR . . . 122.34 17.04 3.7 Favored Glycine 0 N--CA 1.494 2.561 0 O-C-N 121.213 -1.169 . . . . 40.0 110.739 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.549 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -75.64 -167.65 0.72 Allowed 'General case' 0 C--O 1.198 -1.628 0 O-C-N 120.989 -1.301 . . . . 40.0 110.426 -179.345 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.8 mm -134.46 141.56 43.13 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.542 0 CA-C-O 121.506 0.669 . . . . 40.0 110.239 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -153.46 145.91 24.06 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.173 -0.954 . . . . 40.0 110.033 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.68 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -92.24 -17.54 24.67 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.444 -0.785 . . . . 40.0 110.14 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.493 HD21 ' H ' ' A' ' 63' ' ' LEU . 66.5 t30 67.21 32.9 5.79 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.06 -1.025 . . . . 40.0 111.419 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.68 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 0.8 OUTLIER -60.84 -29.32 69.43 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.981 -1.074 . . . . 40.0 108.439 178.529 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.437 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 23.8 mp0 -64.63 -13.91 55.72 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.526 -0.546 . . . . 40.0 109.526 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.25 42.69 94.05 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 109.683 -1.367 . . . . 40.0 109.683 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.619 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.57 -10.27 30.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.647 -0.914 . . . . 40.0 109.197 -179.592 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.554 HD21 ' CD2' ' A' ' 106' ' ' PHE . 30.7 mt -138.94 164.05 42.12 Favored Pre-proline 0 N--CA 1.492 1.659 0 N-CA-C 108.535 -0.913 . . . . 40.0 108.535 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.602 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 87.0 Cg_exo -45.16 139.91 8.16 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.025 1.817 . . . . 40.0 111.659 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.643 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.04 -166.29 11.69 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 110.392 -1.083 . . . . 40.0 110.392 -178.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.555 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 pttm 173.33 -158.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 107.859 -1.163 . . . . 40.0 107.859 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' A' ' 67' ' ' SER . 24.2 p -73.64 85.42 1.6 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.165 -1.42 . . . . 40.0 107.165 177.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.555 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 79.72 99.94 0.28 Allowed Glycine 0 N--CA 1.496 2.679 0 N-CA-C 108.863 -1.695 . . . . 40.0 108.863 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.643 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 16.9 tpp180 -123.45 140.89 52.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.535 -0.979 . . . . 40.0 110.508 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.612 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 29.5 p -108.83 130.25 55.4 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.632 -0.877 . . . . 40.0 108.632 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.602 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 30.7 m95 -121.48 146.85 46.49 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.343 -0.848 . . . . 40.0 110.381 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.649 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.9 OUTLIER -145.89 146.88 31.26 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.538 -0.726 . . . . 40.0 109.624 -179.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.632 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.3 170.72 8.32 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.177 -1.009 . . . . 40.0 112.352 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.445 ' O ' HG22 ' A' ' 88' ' ' ILE . . . -157.36 145.41 19.13 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.487 -0.758 . . . . 40.0 109.981 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.669 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -70.44 153.25 43.16 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.551 -0.718 . . . . 40.0 110.408 -179.206 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.489 HG21 ' CE2' ' A' ' 7' ' ' PHE . 17.8 mm -137.61 153.37 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 40.0 110.088 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.489 HD22 ' CG ' ' A' ' 86' ' ' ASP . 73.8 m-20 55.07 58.49 4.69 Favored 'General case' 0 N--CA 1.5 2.033 0 CA-C-O 121.186 0.517 . . . . 40.0 111.267 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.526 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 56.1 t80 -121.83 155.2 35.87 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 40.0 108.739 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.576 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.8 p -132.32 -79.91 0.5 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 121.672 0.749 . . . . 40.0 109.84 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.576 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.27 101.67 2.86 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.88 -0.785 . . . . 40.0 108.88 -179.284 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.14 -109.09 0.4 Allowed Glycine 0 N--CA 1.5 2.952 0 C-N-CA 119.753 -1.213 . . . . 40.0 110.108 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.445 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.5 t80 -119.42 -177.97 3.49 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.358 -1.084 . . . . 40.0 110.06 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.445 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 4.2 mtm180 -84.47 -150.33 0.12 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.463 -0.773 . . . . 40.0 110.561 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.406 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.7 p30 -164.98 -135.93 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.743 -0.836 . . . . 40.0 108.743 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 100' ' ' THR . 45.6 p -114.21 -10.25 12.77 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.835 -1.166 . . . . 40.0 109.417 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.606 ' OD1' HG22 ' A' ' 100' ' ' THR . 15.5 m-20 -73.04 106.43 4.91 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.95 0.405 . . . . 40.0 110.131 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.858 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -134.05 139.27 45.88 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 119.585 -0.846 . . . . 40.0 110.172 179.768 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.639 ' O ' HD22 ' A' ' 89' ' ' LEU . 18.1 tt -110.12 148.78 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-O 122.064 0.935 . . . . 40.0 110.56 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.639 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.0 mm? -125.21 128.5 48.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.582 -0.699 . . . . 40.0 109.393 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.649 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.4 p90 -131.07 141.71 50.21 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 109.043 -0.725 . . . . 40.0 109.043 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.549 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 60.0 p -107.28 -179.11 3.83 Favored 'General case' 0 N--CA 1.504 2.252 0 CA-C-O 122.162 0.982 . . . . 40.0 112.209 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.612 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -54.55 -53.6 52.33 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.324 1.059 . . . . 40.0 108.794 177.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.58 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -65.9 2.2 1.14 Allowed 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 114.643 -1.162 . . . . 40.0 109.975 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 78.5 m95 73.56 16.85 3.88 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 122.017 -0.427 . . . . 40.0 111.652 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.477 HD23 ' HA ' ' A' ' 95' ' ' LEU . 24.4 mt -70.52 126.56 29.97 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 106.79 -1.559 . . . . 40.0 106.79 177.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.821 HG22 HD11 ' A' ' 109' ' ' ILE . 2.7 mp -114.26 134.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 122.706 1.241 . . . . 40.0 112.013 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.524 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 10.3 m-85 -127.68 158.88 36.4 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.95 -1.13 . . . . 40.0 107.95 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.435 ' HB3' HD13 ' A' ' 109' ' ' ILE . 5.4 ptmm? -127.13 145.79 50.62 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 118.634 -1.226 . . . . 40.0 112.291 -178.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.454 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.97 129.81 32.69 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 106.897 -1.52 . . . . 40.0 106.897 177.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.606 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.4 p -115.98 9.93 15.0 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 109.585 -0.524 . . . . 40.0 109.585 -177.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.594 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.2 34.21 5.0 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.821 -0.751 . . . . 40.0 109.818 178.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 62.46 67.47 0.72 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.16 -0.963 . . . . 40.0 111.077 178.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 61.15 43.21 11.34 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -0.825 . . . . 40.0 110.451 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.594 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.5 mm-40 -115.88 -77.92 0.57 Allowed 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.614 -1.304 . . . . 40.0 109.267 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.503 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.2 p -93.74 120.82 34.51 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.068 -1.02 . . . . 40.0 110.207 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.556 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 6.1 m-85 -102.73 83.77 2.31 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.378 0.609 . . . . 40.0 110.685 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.28 144.88 35.75 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.213 -0.995 . . . . 40.0 108.903 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.543 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 57.8 tttp -76.67 146.99 37.75 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.214 0.53 . . . . 40.0 110.322 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.821 HD11 HG22 ' A' ' 96' ' ' ILE . 15.6 pt -130.22 -28.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 109.148 -0.686 . . . . 40.0 109.148 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.603 ' HG2' HH11 ' A' ' 110' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 N-CA-C 109.128 -0.693 . . . . 40.0 109.128 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.68 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.8 t . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 109.249 -0.649 . . . . 40.0 109.249 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.587 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 10.6 mt -139.24 147.7 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.453 -0.78 . . . . 40.0 109.415 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -149.55 34.4 0.7 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.276 -0.89 . . . . 40.0 109.712 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.3 p -119.51 144.75 46.85 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.913 -0.715 . . . . 40.0 110.115 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.518 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 62.5 m-85 -45.6 -86.83 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.49 -0.757 . . . . 40.0 112.752 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.633 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -46.18 -48.05 17.61 Favored 'General case' 0 C--N 1.289 -2.061 0 O-C-N 121.672 -0.643 . . . . 40.0 109.761 -178.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.14 -53.35 23.62 Favored Glycine 0 N--CA 1.502 3.071 0 N-CA-C 110.149 -1.18 . . . . 40.0 110.149 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.83 -44.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 O-C-N 120.867 -1.372 . . . . 40.0 109.733 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 1.02 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.76 -57.06 14.09 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.257 -0.902 . . . . 40.0 109.934 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.99 -47.05 65.07 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 178.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.438 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.7 t80 -54.63 -50.26 68.54 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.901 0.858 . . . . 40.0 109.057 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.686 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 72.2 mt -70.72 -44.7 66.31 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.727 -0.608 . . . . 40.0 110.618 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.565 ' HG3' HD11 ' A' ' 96' ' ' ILE . 4.9 mt-30 -61.73 -26.86 68.32 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 119.122 -1.031 . . . . 40.0 110.722 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.9 m -102.28 -44.22 5.47 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.872 -1.143 . . . . 40.0 111.926 -178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.591 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.5 m-85 -102.85 -16.2 15.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.906 -1.121 . . . . 40.0 110.425 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.686 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 62.1 -27.58 0.06 Allowed 'General case' 0 N--CA 1.502 2.169 0 CA-C-O 121.36 0.6 . . . . 40.0 110.895 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -71.28 122.41 20.21 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 120.82 -1.175 . . . . 40.0 108.756 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.682 ' HA ' HD21 ' A' ' 14' ' ' LEU . 2.0 mt -47.29 132.36 9.76 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.428 -0.795 . . . . 40.0 109.144 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.52 ' HD2' HD23 ' A' ' 20' ' ' LEU . 71.5 Cg_exo -40.0 131.71 2.07 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 122.199 1.932 . . . . 40.0 112.626 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.625 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.47 78.59 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.876 0.845 . . . . 40.0 110.335 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.68 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 170.47 15.17 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.915 -0.491 . . . . 40.0 110.503 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.435 ' HA ' ' O ' ' A' ' 50' ' ' SER . 17.5 m-85 -114.18 167.13 10.95 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.497 -0.752 . . . . 40.0 111.233 -179.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.55 152.1 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 40.0 109.049 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.448 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 77.8 p -72.17 151.67 42.8 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 108.405 -0.961 . . . . 40.0 108.405 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.649 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -50.83 -51.9 46.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.759 -1.213 . . . . 40.0 108.38 177.883 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.7 t -46.32 -62.91 1.14 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.841 -0.537 . . . . 40.0 110.252 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.479 ' O ' HD12 ' A' ' 33' ' ' LEU . 45.2 mt-10 -48.74 -58.02 5.42 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.019 -0.734 . . . . 40.0 109.019 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.18 -49.33 64.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.591 -0.693 . . . . 40.0 109.575 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -64.86 -48.21 75.11 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.369 -0.832 . . . . 40.0 111.034 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -31.8 72.1 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 40.0 110.746 -179.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 29' ' ' GLU . 0.5 OUTLIER -66.92 -20.51 65.92 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.77 -0.826 . . . . 40.0 108.77 179.749 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.562 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 132.61 -3.66 5.05 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 120.127 -1.035 . . . . 40.0 111.031 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -60.94 114.32 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.549 -1.56 . . . . 40.0 108.318 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.8 142.85 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.376 -0.828 . . . . 40.0 110.48 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.46 -48.97 79.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.495 -0.753 . . . . 40.0 110.648 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 p -78.09 46.88 0.62 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.112 -0.992 . . . . 40.0 109.147 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -169.92 -50.37 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 108.824 -0.806 . . . . 40.0 108.824 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.92 20.23 75.96 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.1 -1.6 . . . . 40.0 109.1 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.562 HD21 ' C ' ' A' ' 34' ' ' GLY . 6.7 p-10 -55.19 127.23 28.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.68 -0.894 . . . . 40.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.576 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.4 tp -166.83 -55.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 108.533 -0.914 . . . . 40.0 108.533 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -29.74 53.41 Favored 'General case' 0 C--N 1.288 -2.069 0 O-C-N 121.052 -1.03 . . . . 40.0 110.065 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -62.73 1.34 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.396 -0.815 . . . . 40.0 109.443 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 24.4 m -71.57 -23.18 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-N 116.23 -0.441 . . . . 40.0 109.988 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.648 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.11 76.2 10.44 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 120.981 -1.075 . . . . 40.0 108.937 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -58.73 53.27 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.504 0 C-N-CA 122.391 2.06 . . . . 40.0 113.274 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.69 38.05 0.06 OUTLIER Glycine 0 N--CA 1.5 2.951 0 C-N-CA 119.913 -1.137 . . . . 40.0 111.577 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.648 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 19.9 tttt -119.72 148.34 43.51 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.795 -1.415 . . . . 40.0 110.092 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 5.2 m -120.26 134.8 55.19 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.136 -0.978 . . . . 40.0 109.93 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.461 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.9 mm -67.05 155.35 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -0.966 . . . . 40.0 110.815 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.527 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.43 148.08 4.67 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 119.615 -1.279 . . . . 40.0 110.257 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 123.53 15.99 3.53 Favored Glycine 0 N--CA 1.496 2.642 0 C-N-CA 119.865 -1.159 . . . . 40.0 110.997 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.649 ' CG ' ' HZ2' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -74.31 -168.87 0.71 Allowed 'General case' 0 C--O 1.192 -1.936 0 O-C-N 121.04 -1.27 . . . . 40.0 110.386 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -132.85 140.92 46.26 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 CA-C-O 121.728 0.775 . . . . 40.0 110.423 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -153.43 148.12 26.31 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.475 -0.765 . . . . 40.0 109.149 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.682 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.29 -19.96 20.22 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.465 -0.772 . . . . 40.0 110.211 -179.165 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.518 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.8 t30 69.95 31.19 3.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.448 -0.782 . . . . 40.0 111.889 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.682 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.4 mtm-85 -59.02 -31.15 68.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.821 -1.174 . . . . 40.0 108.129 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.466 ' H ' ' CD ' ' A' ' 60' ' ' GLU . 22.0 mp0 -62.88 -8.92 7.95 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.228 -0.656 . . . . 40.0 109.228 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 58.55 44.05 95.7 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.367 -1.093 . . . . 40.0 110.367 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.664 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.61 -12.29 25.86 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.61 -0.935 . . . . 40.0 108.78 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.603 HD21 ' CD2' ' A' ' 106' ' ' PHE . 28.3 mt -136.2 162.69 55.06 Favored Pre-proline 0 N--CA 1.499 2.024 0 N-CA-C 108.135 -1.061 . . . . 40.0 108.135 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.443 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 93.5 Cg_exo -42.78 142.32 2.14 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 121.98 1.786 . . . . 40.0 112.622 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.609 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.62 -166.42 11.5 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.002 -1.239 . . . . 40.0 110.002 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.5 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.0 pttm 171.5 -158.48 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 107.126 -1.435 . . . . 40.0 107.126 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 67' ' ' SER . 51.0 p -72.4 87.71 1.17 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 107.012 -1.477 . . . . 40.0 107.012 177.013 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.5 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.42 103.97 0.11 Allowed Glycine 0 N--CA 1.498 2.772 0 N-CA-C 109.559 -1.416 . . . . 40.0 109.559 -178.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.618 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -124.02 140.85 52.57 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.529 -0.983 . . . . 40.0 110.347 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.64 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 24.1 p -105.99 130.04 54.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.279 -1.008 . . . . 40.0 108.279 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.559 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 31.3 m95 -124.27 140.38 53.02 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.726 -0.789 . . . . 40.0 110.585 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.592 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.7 OUTLIER -143.5 149.55 37.67 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.286 -0.883 . . . . 40.0 108.926 -179.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.636 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -116.76 175.34 5.62 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.293 -0.879 . . . . 40.0 112.65 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.527 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -162.24 142.53 10.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.557 -0.715 . . . . 40.0 110.27 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.656 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -67.73 153.17 44.31 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.74 -0.6 . . . . 40.0 110.844 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.518 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 13.8 mm -136.93 151.61 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.382 -0.823 . . . . 40.0 109.798 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.9 m-20 57.27 53.71 7.43 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.143 0.496 . . . . 40.0 111.98 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.576 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 60.3 t80 -118.1 155.14 30.91 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.159 -0.963 . . . . 40.0 109.123 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 42.0 p -133.28 -78.2 0.48 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.716 0.769 . . . . 40.0 109.876 178.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.74 102.94 2.89 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 109.078 -0.712 . . . . 40.0 109.078 -179.546 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -105.95 0.29 Allowed Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.788 -1.325 . . . . 40.0 109.788 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.431 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 14.1 t80 -126.38 -175.83 3.49 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -1.031 . . . . 40.0 109.942 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.432 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.5 mtm180 -84.75 -153.44 0.16 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.417 -0.802 . . . . 40.0 110.38 -178.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -163.7 -135.13 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.759 -0.83 . . . . 40.0 108.759 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' A' ' 100' ' ' THR . 28.1 p -113.84 -10.55 12.96 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.975 -1.078 . . . . 40.0 109.791 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.625 ' OD1' HG22 ' A' ' 100' ' ' THR . 14.1 m-20 -73.91 108.21 6.59 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 120.858 0.361 . . . . 40.0 110.821 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.828 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.03 140.48 45.64 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.469 -0.892 . . . . 40.0 110.391 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.619 HD11 HG21 ' A' ' 96' ' ' ILE . 18.1 tt -111.33 148.33 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 CA-C-O 122.108 0.956 . . . . 40.0 109.917 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.525 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.6 mm? -124.82 128.74 49.18 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.478 -0.764 . . . . 40.0 109.082 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.25 141.58 50.02 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.273 -0.892 . . . . 40.0 109.67 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.559 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.7 p -106.52 179.57 4.23 Favored 'General case' 0 N--CA 1.505 2.314 0 CA-C-O 122.51 1.148 . . . . 40.0 112.666 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.64 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.82 -51.98 58.8 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.381 1.086 . . . . 40.0 109.118 177.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.618 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 5.1 1.24 Allowed 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 114.673 -1.149 . . . . 40.0 110.2 -178.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.494 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 61.6 m95 72.76 11.52 5.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.882 -0.511 . . . . 40.0 112.097 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' A' ' 95' ' ' LEU . 23.1 mt -67.73 125.14 25.29 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 119.947 -1.72 . . . . 40.0 107.835 178.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 1.02 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.2 mt -112.62 133.25 59.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 122.865 1.317 . . . . 40.0 112.724 -176.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.565 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 16.0 m-85 -125.21 157.68 35.89 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 107.77 -1.196 . . . . 40.0 107.77 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.429 ' NZ ' ' HB2' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.92 141.24 51.6 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 119.205 -0.998 . . . . 40.0 112.934 -177.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.83 131.33 40.9 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.484 -1.302 . . . . 40.0 107.484 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.625 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.9 p -116.44 10.35 14.6 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 109.397 -0.594 . . . . 40.0 109.397 -178.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.573 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -115.3 33.16 5.6 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.585 -0.846 . . . . 40.0 109.854 179.293 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 63.98 66.68 0.64 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.262 -0.899 . . . . 40.0 111.071 178.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 60.88 43.25 12.03 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.386 -0.821 . . . . 40.0 110.108 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.573 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.4 mm-40 -116.26 -76.92 0.57 Allowed 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.712 -1.243 . . . . 40.0 109.217 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.554 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.9 p -94.81 121.96 36.94 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.664 -1.273 . . . . 40.0 110.433 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.603 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.7 m-85 -102.9 86.14 2.67 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 40.0 110.584 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.5 m -79.28 146.42 32.99 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.197 -1.001 . . . . 40.0 108.334 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.565 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 57.5 tttp -78.28 146.32 34.89 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.304 0.573 . . . . 40.0 110.371 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.788 HD11 ' CG2' ' A' ' 96' ' ' ILE . 29.1 pt -126.97 -31.66 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 N-CA-C 108.933 -0.766 . . . . 40.0 108.933 177.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.633 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.586 -0.721 . . . . 40.0 109.269 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.658 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.7 t . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 109.488 -0.56 . . . . 40.0 109.488 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.538 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.3 mt -137.97 149.74 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.461 -0.774 . . . . 40.0 109.419 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -149.22 36.07 0.74 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.046 -1.034 . . . . 40.0 109.745 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p -119.9 140.51 50.75 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.451 -0.9 . . . . 40.0 110.518 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.581 ' CE2' HG21 ' A' ' 76' ' ' ILE . 74.3 m-85 -41.2 -80.66 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.179 0.514 . . . . 40.0 111.746 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.544 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -50.65 -45.83 58.07 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.566 -0.709 . . . . 40.0 111.108 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.04 -52.0 37.69 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 109.977 -1.249 . . . . 40.0 109.977 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.47 -44.27 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.404 -1.056 . . . . 40.0 109.672 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.823 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.66 -55.04 40.17 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.681 0.753 . . . . 40.0 109.408 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -44.36 88.66 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.953 -0.758 . . . . 40.0 108.953 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.513 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.9 t80 -56.91 -48.24 78.7 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 122.233 1.016 . . . . 40.0 108.52 178.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.537 HD21 ' HA ' ' A' ' 20' ' ' LEU . 39.8 mt -68.73 -45.7 70.82 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.774 -0.579 . . . . 40.0 110.3 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -65.17 -24.34 67.35 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 118.66 -1.216 . . . . 40.0 111.22 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.3 m -98.27 -43.79 6.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.845 -1.159 . . . . 40.0 111.571 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.581 ' C ' ' H ' ' A' ' 19' ' ' LYS . 74.5 m-85 -108.98 -11.98 14.92 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.188 -0.945 . . . . 40.0 111.223 -177.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.497 ' CG ' ' CZ2' ' A' ' 94' ' ' TRP . 2.3 m-70 61.27 -25.62 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 121.567 0.699 . . . . 40.0 111.041 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.588 ' NZ ' ' OD2' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -72.9 121.55 20.19 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 120.313 -1.492 . . . . 40.0 108.988 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.537 ' HA ' HD21 ' A' ' 14' ' ' LEU . 4.0 mt -48.02 129.34 12.07 Favored Pre-proline 0 C--N 1.283 -2.309 0 O-C-N 121.463 -0.773 . . . . 40.0 109.281 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.426 ' O ' ' N ' ' A' ' 23' ' ' ASN . 73.9 Cg_exo -33.62 133.48 0.12 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.624 2.216 . . . . 40.0 113.052 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.588 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -64.0 74.98 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.653 0.739 . . . . 40.0 110.258 -179.354 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.658 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 171.72 18.21 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.719 -0.613 . . . . 40.0 110.322 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -115.28 165.15 13.27 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.601 -0.687 . . . . 40.0 110.735 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -155.93 149.87 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 108.744 -0.835 . . . . 40.0 108.744 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.406 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 69.8 p -69.47 153.68 43.16 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.422 -0.799 . . . . 40.0 110.02 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.29 -51.46 58.44 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.14 -1.43 . . . . 40.0 107.14 177.042 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.8 t -47.36 -62.23 1.53 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.48 -0.763 . . . . 40.0 110.362 178.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 38.9 mt-10 -49.28 -57.2 7.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.356 -0.84 . . . . 40.0 109.356 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.04 -49.43 66.33 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.674 0.749 . . . . 40.0 109.79 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -63.58 -49.59 72.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.728 -0.607 . . . . 40.0 110.16 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.51 -30.02 68.75 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 40.0 110.519 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 mt -66.72 -19.73 65.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.107 -0.996 . . . . 40.0 109.077 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.523 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.74 -1.4 5.14 Favored Glycine 0 N--CA 1.499 2.835 0 C-N-CA 120.073 -1.061 . . . . 40.0 111.143 179.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -61.54 114.88 3.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.657 -1.496 . . . . 40.0 109.301 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.8 t -123.32 140.24 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 O-C-N 121.262 -0.899 . . . . 40.0 109.962 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.39 -49.36 78.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 40.0 110.171 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 p -76.64 47.55 0.5 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.218 -0.926 . . . . 40.0 109.425 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -170.89 -49.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.645 -0.659 . . . . 40.0 109.283 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.62 17.4 74.78 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 109.173 -1.571 . . . . 40.0 109.173 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.523 HD21 ' C ' ' A' ' 34' ' ' GLY . 7.4 p-10 -55.61 130.95 45.09 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.455 -1.026 . . . . 40.0 108.946 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.588 HD11 HD11 ' A' ' 51' ' ' ILE . 1.4 tp -169.85 -55.77 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.704 -1.221 . . . . 40.0 107.704 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.76 -27.38 63.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.324 -0.86 . . . . 40.0 110.241 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.02 -57.31 3.95 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.847 0.832 . . . . 40.0 109.455 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.2 m -72.54 -29.4 30.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.955 -1.128 . . . . 40.0 107.955 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.565 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -143.05 79.38 14.48 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 121.557 -0.714 . . . . 40.0 110.306 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.11 54.9 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 122.081 1.854 . . . . 40.0 113.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.12 40.7 0.06 OUTLIER Glycine 0 N--CA 1.503 3.135 0 C-N-CA 119.758 -1.211 . . . . 40.0 111.408 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 15.2 tttt -121.54 138.99 54.07 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.947 -1.325 . . . . 40.0 109.872 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 m -111.99 132.43 54.79 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.032 -1.043 . . . . 40.0 109.283 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.588 HD11 HD11 ' A' ' 42' ' ' LEU . 4.3 mm -63.54 151.29 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.373 -0.829 . . . . 40.0 110.028 -179.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.405 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 152.98 144.49 3.92 Favored Glycine 0 N--CA 1.488 2.116 0 C-N-CA 118.789 -1.672 . . . . 40.0 110.651 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 126.79 15.33 2.64 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 119.841 -1.171 . . . . 40.0 111.225 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.565 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -72.79 -170.36 0.69 Allowed 'General case' 0 C--O 1.198 -1.63 0 O-C-N 120.841 -1.388 . . . . 40.0 110.205 -179.291 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 5.6 mm -134.11 138.96 49.27 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-O 121.489 0.662 . . . . 40.0 110.203 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -151.03 148.83 28.83 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.581 -0.699 . . . . 40.0 109.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.693 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.68 -21.16 19.53 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.504 -0.748 . . . . 40.0 110.777 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.509 HD21 ' H ' ' A' ' 63' ' ' LEU . 66.3 t30 71.12 28.12 3.15 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 40.0 111.839 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.693 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.7 mtm-85 -56.64 -32.36 65.27 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.957 -1.089 . . . . 40.0 108.151 178.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.433 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 24.6 mp0 -63.46 -9.22 11.73 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.401 -0.592 . . . . 40.0 109.401 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.93 44.66 97.86 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.236 -1.146 . . . . 40.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.663 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -93.8 -12.85 28.16 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.649 -0.912 . . . . 40.0 108.552 179.679 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.638 HD21 ' CD2' ' A' ' 106' ' ' PHE . 36.5 mt -138.04 166.57 25.01 Favored Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 108.744 -0.836 . . . . 40.0 108.744 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.6 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 81.7 Cg_exo -46.36 136.57 15.11 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 121.862 1.708 . . . . 40.0 112.387 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.622 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -125.81 -168.56 12.7 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.436 -1.466 . . . . 40.0 109.436 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.592 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 4.0 pttm 175.35 -156.28 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 106.867 -1.531 . . . . 40.0 106.867 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.428 ' O ' ' OG ' ' A' ' 67' ' ' SER . 41.2 p -75.85 87.15 2.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.32 -1.487 . . . . 40.0 107.155 177.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.592 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 76.89 105.83 0.15 Allowed Glycine 0 N--CA 1.497 2.756 0 N-CA-C 108.262 -1.935 . . . . 40.0 108.262 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.622 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.1 tpp180 -128.08 142.72 51.13 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.388 -1.066 . . . . 40.0 110.419 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.606 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.75 130.07 55.37 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 108.89 -0.782 . . . . 40.0 108.89 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.6 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 31.3 m95 -123.33 143.57 50.01 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 119.931 -0.708 . . . . 40.0 110.838 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.565 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.6 OUTLIER -145.28 148.47 33.5 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.243 -0.91 . . . . 40.0 109.693 -179.363 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -115.39 169.74 8.93 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.227 -0.92 . . . . 40.0 111.856 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.405 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -156.01 144.37 20.01 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.336 -0.616 . . . . 40.0 109.336 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.643 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -69.59 154.32 42.17 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.621 -0.674 . . . . 40.0 110.631 -178.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.581 HG21 ' CE2' ' A' ' 7' ' ' PHE . 16.9 mm -137.08 152.67 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.164 -0.96 . . . . 40.0 109.908 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.498 HD22 ' CG ' ' A' ' 86' ' ' ASP . 74.3 m-20 56.35 57.18 5.11 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.031 0.444 . . . . 40.0 111.492 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.466 ' CG ' ' N ' ' A' ' 79' ' ' THR . 65.1 t80 -120.85 153.66 36.83 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.257 -0.902 . . . . 40.0 109.317 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.2 p -132.55 -78.63 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.888 0.851 . . . . 40.0 109.602 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.44 102.17 2.72 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.855 -0.794 . . . . 40.0 108.855 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.48 -104.92 0.26 Allowed Glycine 0 N--CA 1.498 2.819 0 C-N-CA 119.557 -1.306 . . . . 40.0 109.961 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.1 t80 -126.59 -176.15 3.6 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.638 -0.919 . . . . 40.0 109.453 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.419 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.6 mtm180 -84.19 -150.69 0.12 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.379 -0.826 . . . . 40.0 110.212 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.444 HD21 ' HB2' ' A' ' 86' ' ' ASP . 41.9 p-10 -164.77 -134.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.567 -0.901 . . . . 40.0 108.567 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 26.5 p -115.66 -9.78 11.92 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.048 -1.033 . . . . 40.0 109.681 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.638 ' OD1' HG22 ' A' ' 100' ' ' THR . 20.3 m-20 -75.17 108.76 8.13 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 120.798 0.332 . . . . 40.0 110.821 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.832 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.22 140.15 45.06 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.34 -0.944 . . . . 40.0 109.734 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.666 HD11 HG21 ' A' ' 96' ' ' ILE . 13.8 tt -109.75 148.48 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 CA-C-O 122.019 0.914 . . . . 40.0 110.137 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.583 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.8 mm? -124.18 129.15 50.32 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.768 -0.827 . . . . 40.0 108.768 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.512 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 5.6 p90 -132.53 140.94 48.53 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 109.658 -0.497 . . . . 40.0 109.658 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 71.5 p -107.54 -178.86 3.75 Favored 'General case' 0 N--CA 1.506 2.366 0 CA-C-O 122.292 1.044 . . . . 40.0 112.504 -177.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.606 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -55.5 -50.17 70.65 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 122.193 0.997 . . . . 40.0 109.216 177.493 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.565 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -68.07 1.07 2.99 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.022 -0.99 . . . . 40.0 109.536 -179.375 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 77.2 m95 73.01 17.2 4.2 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 122.089 -0.382 . . . . 40.0 111.116 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 95' ' ' LEU . 23.4 mt -70.39 125.45 26.85 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.146 -1.428 . . . . 40.0 107.146 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.823 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.6 mp -113.11 133.88 57.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 CA-C-O 122.767 1.27 . . . . 40.0 112.357 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.576 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.1 m-85 -126.75 158.83 35.48 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 107.985 -1.117 . . . . 40.0 107.985 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.431 ' NZ ' ' CZ ' ' A' ' 7' ' ' PHE . 4.8 ptmm? -127.71 142.18 51.4 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.218 -0.993 . . . . 40.0 112.983 -177.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.4 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -132.26 130.84 41.43 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.567 -1.272 . . . . 40.0 107.567 176.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.638 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.1 p -115.88 8.51 14.76 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 109.534 -0.543 . . . . 40.0 109.534 -178.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.581 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.74 31.62 6.4 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.845 -0.742 . . . . 40.0 110.016 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 65.22 67.27 0.52 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.104 -0.998 . . . . 40.0 111.04 178.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 61.04 43.0 11.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.409 -0.807 . . . . 40.0 110.398 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.581 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 26.6 mm-40 -116.65 -77.39 0.57 Allowed 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.57 -1.331 . . . . 40.0 109.603 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.519 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 20.4 p -94.61 122.41 37.18 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.98 -1.075 . . . . 40.0 110.096 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.638 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.1 m-85 -103.91 84.87 2.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.558 -0.713 . . . . 40.0 110.385 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.5 m -78.24 143.74 36.83 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.918 -1.114 . . . . 40.0 108.519 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.576 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 58.2 tttp -75.03 143.39 43.55 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.666 -0.646 . . . . 40.0 110.621 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.757 HD11 HG22 ' A' ' 96' ' ' ILE . 31.9 pt -124.29 -29.96 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.798 -0.815 . . . . 40.0 108.798 177.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.554 ' HG2' HH11 ' A' ' 110' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.042 0 CA-C-O 118.719 -0.658 . . . . 40.0 109.304 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.689 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.2 t . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 109.145 -0.687 . . . . 40.0 109.145 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.552 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -139.06 147.61 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.336 -0.853 . . . . 40.0 109.433 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -147.22 33.35 0.89 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.335 -0.853 . . . . 40.0 110.349 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.6 p -117.79 142.17 47.59 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.571 0.701 . . . . 40.0 110.699 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.576 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 66.2 m-85 -42.52 -85.64 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 CA-C-O 122.229 1.014 . . . . 40.0 113.392 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.661 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -45.84 -48.27 15.83 Favored 'General case' 0 C--N 1.285 -2.21 0 O-C-N 121.527 -0.733 . . . . 40.0 109.896 -179.952 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.6 -53.82 23.66 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 110.353 -1.099 . . . . 40.0 110.353 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.9 t -63.99 -44.24 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.349 -1.089 . . . . 40.0 109.725 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 1.09 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.97 -54.2 49.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.915 -1.116 . . . . 40.0 109.961 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -45.43 74.68 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.447 0.641 . . . . 40.0 109.505 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.597 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.7 t80 -56.74 -49.77 74.23 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.063 -1.088 . . . . 40.0 108.063 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.703 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.4 mt -68.29 -44.42 75.53 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.897 -0.721 . . . . 40.0 109.592 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.538 ' HG3' HD11 ' A' ' 96' ' ' ILE . 8.1 mt-30 -65.37 -24.1 67.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.715 -1.241 . . . . 40.0 111.154 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 m -99.9 -50.2 4.09 Favored 'General case' 0 N--CA 1.516 2.842 0 O-C-N 121.106 -0.997 . . . . 40.0 111.809 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.631 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.7 m-85 -98.95 -16.23 18.83 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 120.92 -1.112 . . . . 40.0 111.76 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.703 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.12 -19.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 121.395 0.617 . . . . 40.0 111.206 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.631 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -74.1 118.39 17.0 Favored 'General case' 0 C--N 1.291 -1.961 0 O-C-N 121.295 -0.878 . . . . 40.0 109.822 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.575 ' HA ' HD21 ' A' ' 14' ' ' LEU . 4.8 mt -43.84 128.14 4.17 Favored Pre-proline 0 N--CA 1.498 1.936 0 N-CA-C 107.505 -1.294 . . . . 40.0 107.505 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.468 ' HD2' HD23 ' A' ' 20' ' ' LEU . 52.8 Cg_exo -36.46 134.0 0.33 Allowed 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.008 2.472 . . . . 40.0 112.575 -178.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.627 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -63.76 78.21 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.6 -0.688 . . . . 40.0 110.254 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.689 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 168.24 16.27 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.468 -0.77 . . . . 40.0 110.399 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.417 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.8 m-85 -115.13 166.05 12.25 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 122.021 0.915 . . . . 40.0 110.944 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -155.7 151.25 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.186 -0.947 . . . . 40.0 109.022 178.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 53' ' ' GLY . 80.5 p -70.58 154.43 41.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.34 -0.85 . . . . 40.0 110.241 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.62 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.59 -51.72 58.56 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.228 -1.397 . . . . 40.0 107.228 177.138 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.7 t -46.58 -62.94 1.15 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.615 -0.678 . . . . 40.0 110.064 178.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -47.62 -58.15 4.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.408 -0.807 . . . . 40.0 109.435 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.457 ' HB2' HD12 ' A' ' 25' ' ' ILE . . . -52.71 -50.3 63.63 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.493 -0.755 . . . . 40.0 109.526 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.16 -49.86 72.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.849 -0.532 . . . . 40.0 110.768 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.48 -29.62 68.29 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.23 -0.919 . . . . 40.0 110.467 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -17.02 64.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.767 -1.208 . . . . 40.0 109.079 178.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.523 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 128.12 1.18 6.31 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 120.376 -0.916 . . . . 40.0 111.434 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -64.25 115.56 5.15 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.469 -1.606 . . . . 40.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 51.8 t -122.97 143.29 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 121.355 -0.841 . . . . 40.0 110.401 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.84 -49.09 76.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.572 -0.705 . . . . 40.0 109.97 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 p -78.69 50.62 1.0 Allowed 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.698 -0.853 . . . . 40.0 108.698 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 tttp -172.83 -51.44 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.738 -0.838 . . . . 40.0 108.738 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.99 20.33 76.15 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 108.939 -1.665 . . . . 40.0 108.939 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.523 HD21 ' C ' ' A' ' 34' ' ' GLY . 6.2 p-10 -55.73 128.08 33.1 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.987 -0.746 . . . . 40.0 108.987 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.678 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.1 tp -166.86 -56.65 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.917 0.865 . . . . 40.0 109.074 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.39 -28.57 59.65 Favored 'General case' 0 C--N 1.289 -2.039 0 O-C-N 121.14 -0.975 . . . . 40.0 110.384 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.5 -62.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.532 -0.73 . . . . 40.0 109.299 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.409 ' H ' HG22 ' A' ' 45' ' ' VAL . 14.7 m -69.41 -29.66 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 CA-C-O 121.543 0.687 . . . . 40.0 109.977 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.599 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -142.93 78.55 15.35 Favored Pre-proline 0 C--N 1.299 -1.589 0 O-C-N 121.193 -0.942 . . . . 40.0 109.116 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -56.14 51.33 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 122.349 2.033 . . . . 40.0 114.685 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.25 0.06 OUTLIER Glycine 0 N--CA 1.502 3.087 0 C-N-CA 119.463 -1.351 . . . . 40.0 111.112 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 23.8 tttt -122.92 146.19 47.81 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.757 -1.437 . . . . 40.0 109.329 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.417 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 7.6 m -117.3 131.77 56.74 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.708 -1.245 . . . . 40.0 110.848 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.478 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 8.0 mm -60.27 149.14 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-O 121.63 0.728 . . . . 40.0 110.866 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.419 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 151.94 147.1 4.49 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.152 -1.499 . . . . 40.0 110.916 179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.443 ' O ' HG22 ' A' ' 26' ' ' THR . . . 123.32 17.95 3.17 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.682 -0.77 . . . . 40.0 111.603 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.606 ' OD2' ' NZ ' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -74.21 -169.56 0.81 Allowed 'General case' 0 C--O 1.195 -1.774 0 O-C-N 120.801 -1.411 . . . . 40.0 110.074 -179.331 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.19 139.13 50.01 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.801 0 CA-C-O 121.761 0.791 . . . . 40.0 110.2 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -150.3 147.79 28.06 Favored 'General case' 0 C--N 1.293 -1.882 0 C-N-CA 119.926 -0.71 . . . . 40.0 109.96 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.702 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -95.06 -16.66 22.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.818 -0.551 . . . . 40.0 110.03 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.51 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 67.1 t30 68.11 28.46 6.6 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 40.0 111.785 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.702 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.3 mtm-85 -56.78 -31.82 65.03 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.919 -1.113 . . . . 40.0 108.475 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.45 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 21.1 mp0 -61.85 -13.02 20.43 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.344 -0.613 . . . . 40.0 109.344 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.63 43.89 98.33 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.839 -1.304 . . . . 40.0 109.839 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.644 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -94.47 -12.36 27.86 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.476 -0.935 . . . . 40.0 108.476 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.581 HD21 ' CD2' ' A' ' 106' ' ' PHE . 31.9 mt -136.26 163.75 47.81 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 109.014 -0.736 . . . . 40.0 109.014 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.569 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 92.1 Cg_exo -43.26 137.61 5.06 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.987 1.791 . . . . 40.0 112.366 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.539 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.19 -169.5 12.51 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.065 -1.214 . . . . 40.0 110.065 -178.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.469 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.9 ptmm? 173.9 -158.81 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.138 -1.43 . . . . 40.0 107.138 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 67' ' ' SER . 24.4 p -73.33 88.51 1.55 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.034 -1.469 . . . . 40.0 107.034 177.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.469 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 74.79 103.98 0.09 OUTLIER Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.016 -1.634 . . . . 40.0 109.016 -177.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.607 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.0 tpp180 -125.41 143.06 51.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.942 -0.74 . . . . 40.0 109.467 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.639 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 35.2 p -109.78 133.24 53.37 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.832 -1.173 . . . . 40.0 107.832 178.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.608 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 32.7 m95 -127.17 141.37 51.76 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.815 0.817 . . . . 40.0 110.474 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.629 HH12 ' HA ' ' A' ' 92' ' ' SER . 1.0 OUTLIER -144.89 146.67 32.13 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.54 -0.725 . . . . 40.0 109.378 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.62 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -113.93 172.97 6.66 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.154 -0.966 . . . . 40.0 112.354 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -159.22 143.7 15.42 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.766 -0.584 . . . . 40.0 109.734 179.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.617 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.69 156.37 35.45 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.471 -0.768 . . . . 40.0 110.617 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.576 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 13.8 mm -139.69 152.13 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 40.0 109.463 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.505 HD22 ' CG ' ' A' ' 86' ' ' ASP . 70.7 m-20 56.29 54.93 7.15 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.117 -0.492 . . . . 40.0 111.616 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.678 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 52.7 t80 -116.72 155.49 28.78 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.997 -1.065 . . . . 40.0 108.968 177.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.577 ' OG1' ' N ' ' A' ' 80' ' ' SER . 32.9 p -132.84 -78.08 0.49 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.82 0.819 . . . . 40.0 109.904 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.577 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.0 OUTLIER -152.47 102.73 2.76 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.155 -1.054 . . . . 40.0 108.155 -179.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 151.87 -108.16 0.36 Allowed Glycine 0 N--CA 1.501 3.022 0 N-CA-C 109.762 -1.335 . . . . 40.0 109.762 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.487 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 20.1 t80 -124.67 -178.06 4.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.304 -1.115 . . . . 40.0 109.357 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.487 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 1.3 mtm180 -83.44 -151.49 0.11 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.795 0.807 . . . . 40.0 110.806 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.413 HD21 ' HB2' ' A' ' 77' ' ' ASN . 40.5 p30 -164.6 -133.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.782 -0.822 . . . . 40.0 108.782 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . 0.482 ' OG ' ' O ' ' A' ' 100' ' ' THR . 24.5 p -116.08 -9.88 11.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.033 -1.042 . . . . 40.0 110.249 -179.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.655 ' OD1' HG22 ' A' ' 100' ' ' THR . 17.9 m-20 -74.65 110.9 9.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 122.172 -0.33 . . . . 40.0 110.595 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.831 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -137.15 140.14 41.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.237 -0.914 . . . . 40.0 109.83 179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.629 ' O ' HD22 ' A' ' 89' ' ' LEU . 11.1 tt -110.35 148.79 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 122.389 1.09 . . . . 40.0 110.205 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.629 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -125.62 128.01 47.2 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.663 -0.648 . . . . 40.0 109.323 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.524 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.46 142.61 50.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.479 -0.763 . . . . 40.0 109.249 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.608 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 90.0 p -107.34 178.51 4.52 Favored 'General case' 0 N--CA 1.504 2.241 0 CA-C-O 122.128 0.966 . . . . 40.0 112.679 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.639 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.42 -51.86 56.91 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-O 122.176 0.988 . . . . 40.0 109.059 177.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.607 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.03 5.24 1.22 Allowed 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 114.87 -1.059 . . . . 40.0 109.742 -179.002 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.588 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 77.1 m95 69.53 19.69 7.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 122.05 -0.406 . . . . 40.0 111.608 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 95' ' ' LEU . 21.7 mt -72.87 127.61 33.05 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.285 -1.746 . . . . 40.0 106.285 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 1.09 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.4 mp -112.97 135.99 50.67 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.103 0 CA-C-O 122.914 1.34 . . . . 40.0 111.751 -177.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.628 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.9 m-85 -127.72 158.08 38.59 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 107.75 -1.204 . . . . 40.0 107.75 178.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.427 ' HD2' ' CG2' ' A' ' 109' ' ' ILE . 6.0 ptmm? -127.08 142.64 51.47 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.056 -1.027 . . . . 40.0 112.124 -178.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.48 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.86 129.89 37.08 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.973 -1.491 . . . . 40.0 106.973 178.151 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.655 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.4 p -117.07 9.07 13.51 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 109.506 -0.553 . . . . 40.0 109.506 -177.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.569 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.97 33.4 5.25 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.584 -0.846 . . . . 40.0 109.772 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 64.58 66.27 0.6 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.042 -1.036 . . . . 40.0 110.826 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 60.7 42.74 13.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.479 -0.763 . . . . 40.0 110.408 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.569 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.2 mm-40 -115.53 -77.64 0.57 Allowed 'General case' 0 N--CA 1.509 2.49 0 O-C-N 120.701 -1.249 . . . . 40.0 109.551 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.536 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 19.7 p -93.03 121.1 34.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.606 -1.309 . . . . 40.0 110.177 -178.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.581 ' CD2' HD21 ' A' ' 63' ' ' LEU . 6.7 m-85 -102.33 83.7 2.36 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.644 -0.66 . . . . 40.0 110.911 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.1 m -76.35 144.35 40.18 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 122.106 0.955 . . . . 40.0 109.344 177.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.628 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 57.8 tttp -76.8 146.13 38.04 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 121.496 -0.753 . . . . 40.0 110.031 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.778 HD11 HG22 ' A' ' 96' ' ' ILE . 31.8 pt -127.61 -31.54 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 120.049 -0.66 . . . . 40.0 109.305 178.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.661 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.501 2.121 0 N-CA-C 108.817 -0.809 . . . . 40.0 108.817 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.649 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.542 -0.54 . . . . 40.0 109.542 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.587 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.12 146.49 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 O-C-N 121.648 -0.658 . . . . 40.0 109.463 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.4 p-10 -148.67 32.69 0.78 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.114 -0.991 . . . . 40.0 109.305 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.0 p -119.54 141.56 49.12 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.502 -0.879 . . . . 40.0 110.58 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.562 ' CE2' HG21 ' A' ' 76' ' ' ILE . 58.9 m-85 -41.84 -87.37 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.646 0 N-CA-C 113.486 0.921 . . . . 40.0 113.486 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.658 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -47.57 -46.16 27.75 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.316 -0.865 . . . . 40.0 109.878 -179.494 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.87 47.95 Favored Glycine 0 N--CA 1.497 2.708 0 N-CA-C 110.043 -1.223 . . . . 40.0 110.043 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.44 -43.88 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.124 -1.221 . . . . 40.0 109.368 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.828 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -57.2 -54.6 44.96 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 121.557 0.694 . . . . 40.0 109.785 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -49.18 67.73 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.558 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.1 t80 -51.81 -51.31 57.39 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.952 0.882 . . . . 40.0 109.309 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.603 HD21 ' HA ' ' A' ' 20' ' ' LEU . 66.0 mt -70.04 -45.77 66.46 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.725 -0.61 . . . . 40.0 111.463 -179.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -62.64 -24.2 67.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.853 -1.154 . . . . 40.0 110.568 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.5 m -101.66 -49.22 4.06 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 120.481 -1.387 . . . . 40.0 111.182 -178.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.55 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.4 m-85 -101.64 -14.05 17.57 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.525 -0.735 . . . . 40.0 110.784 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.536 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.8 m-70 61.78 -25.72 0.05 OUTLIER 'General case' 0 N--CA 1.507 2.385 0 O-C-N 121.096 -1.002 . . . . 40.0 111.788 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.588 ' NZ ' ' OD2' ' A' ' 22' ' ' ASP . 0.4 OUTLIER -73.8 123.76 24.78 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.518 -1.364 . . . . 40.0 109.847 -179.402 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.617 HD23 ' HD2' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -48.65 128.86 13.9 Favored Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.426 -0.796 . . . . 40.0 109.339 179.013 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.617 ' HD2' HD23 ' A' ' 20' ' ' LEU . 46.4 Cg_exo -37.62 131.28 0.72 Allowed 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.411 2.074 . . . . 40.0 112.08 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -63.34 78.4 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.838 0.828 . . . . 40.0 110.11 -179.108 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.649 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 170.26 14.44 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.861 -0.524 . . . . 40.0 110.759 -179.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.432 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.9 m-85 -114.17 164.82 13.36 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.84 0.829 . . . . 40.0 111.834 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.79 150.28 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.345 -0.847 . . . . 40.0 109.695 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.433 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 68.2 p -73.07 150.54 42.23 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.227 -0.92 . . . . 40.0 108.708 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.645 ' NZ ' ' OD1' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -48.29 -53.09 18.52 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 107.802 -1.185 . . . . 40.0 107.802 178.321 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.0 t -46.33 -62.2 1.46 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.445 -0.784 . . . . 40.0 110.714 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.433 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 36.1 mt-10 -50.73 -56.07 13.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.874 -1.141 . . . . 40.0 109.009 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.83 -51.07 59.26 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.264 -0.898 . . . . 40.0 109.768 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.79 -48.35 77.23 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.844 -0.535 . . . . 40.0 110.829 -179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.56 -30.67 69.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.368 -0.833 . . . . 40.0 110.467 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mt -68.67 -18.49 64.28 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.17 -0.956 . . . . 40.0 108.759 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.585 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 130.6 -0.7 5.52 Favored Glycine 0 N--CA 1.503 3.157 0 C-N-CA 120.192 -1.004 . . . . 40.0 111.02 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -62.84 113.29 2.96 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.544 -1.563 . . . . 40.0 109.074 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -122.09 141.86 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.344 -0.847 . . . . 40.0 111.032 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.13 -47.32 86.78 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.18 -0.95 . . . . 40.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.5 p -78.52 49.95 0.91 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.735 -1.228 . . . . 40.0 109.258 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -174.27 -49.52 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 109.204 -0.665 . . . . 40.0 109.204 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.02 24.42 73.15 Favored Glycine 0 N--CA 1.497 2.705 0 N-CA-C 109.194 -1.562 . . . . 40.0 109.194 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.585 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.7 p-10 -57.18 130.17 45.0 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.762 -0.846 . . . . 40.0 108.803 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.746 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 6.2 tp -169.34 -56.81 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 108.932 -0.766 . . . . 40.0 108.932 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.46 -27.18 35.69 Favored 'General case' 0 C--N 1.292 -1.907 0 O-C-N 120.751 -1.218 . . . . 40.0 109.803 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.42 -66.14 0.81 Allowed 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.583 0.706 . . . . 40.0 109.629 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.0 m -69.06 -27.13 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.475 -0.766 . . . . 40.0 110.615 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.663 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -143.82 78.35 14.22 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.936 . . . . 40.0 108.494 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -59.42 54.15 0.07 OUTLIER 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 123.409 2.74 . . . . 40.0 113.644 -178.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.34 40.85 0.07 OUTLIER Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.505 -1.331 . . . . 40.0 110.39 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.663 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 26.8 tttt -120.72 148.66 43.65 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.265 -1.138 . . . . 40.0 110.403 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.432 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 4.4 m -120.86 132.0 54.73 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.115 -0.991 . . . . 40.0 110.726 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 1.7 mm -65.05 155.43 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 CA-C-O 122.55 1.167 . . . . 40.0 111.015 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.544 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.84 154.4 6.4 Favored Glycine 0 N--CA 1.483 1.798 0 N-CA-C 109.15 -1.58 . . . . 40.0 109.15 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.411 ' O ' HG22 ' A' ' 26' ' ' THR . . . 117.44 18.15 5.43 Favored Glycine 0 N--CA 1.491 2.354 0 C-N-CA 119.859 -1.162 . . . . 40.0 111.111 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.645 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -76.58 -170.13 1.44 Allowed 'General case' 0 C--O 1.192 -1.923 0 O-C-N 120.607 -1.525 . . . . 40.0 109.758 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 24.0 mm -132.84 138.25 52.21 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.024 0 CA-C-O 121.798 0.809 . . . . 40.0 110.257 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -149.92 149.0 29.79 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.757 -0.589 . . . . 40.0 110.021 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.694 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.59 -17.93 21.86 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.806 -0.559 . . . . 40.0 110.318 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.545 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.9 t30 66.59 27.07 9.68 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.127 -0.983 . . . . 40.0 111.666 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.694 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.0 OUTLIER -55.37 -31.61 61.92 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.2 -1.037 . . . . 40.0 108.2 178.096 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.435 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 21.6 mp0 -64.69 -8.37 14.33 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 108.999 -0.741 . . . . 40.0 108.999 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.15 43.76 98.05 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 110.28 -1.128 . . . . 40.0 110.28 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.654 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -91.8 -13.64 31.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.38 -1.07 . . . . 40.0 109.074 179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.545 ' H ' HD21 ' A' ' 58' ' ' ASN . 25.0 mt -135.25 167.43 22.61 Favored Pre-proline 0 N--CA 1.499 1.991 0 N-CA-C 108.299 -1.0 . . . . 40.0 108.299 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.635 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 88.1 Cg_exo -47.21 141.95 12.59 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.595 1.53 . . . . 40.0 112.344 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.649 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.95 -166.9 11.58 Favored Glycine 0 N--CA 1.493 2.439 0 N-CA-C 110.448 -1.061 . . . . 40.0 110.448 -178.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.561 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.8 pttm 172.96 -156.37 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 106.807 -1.553 . . . . 40.0 106.807 -178.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.43 ' O ' ' OG ' ' A' ' 67' ' ' SER . 57.0 p -75.42 86.44 2.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.656 -1.278 . . . . 40.0 107.901 177.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.561 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.15 99.19 0.31 Allowed Glycine 0 N--CA 1.498 2.802 0 N-CA-C 108.665 -1.774 . . . . 40.0 108.665 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.649 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 17.0 tpp180 -122.56 140.12 53.14 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.349 -1.089 . . . . 40.0 109.878 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.638 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 31.4 p -107.26 131.32 54.33 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 108.212 -1.033 . . . . 40.0 108.212 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.635 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.3 m95 -126.0 141.57 51.9 Favored 'General case' 0 N--CA 1.505 2.322 0 C-N-CA 119.761 -0.776 . . . . 40.0 110.846 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.648 ' HB2' ' CZ ' ' A' ' 90' ' ' TYR . 0.4 OUTLIER -143.8 148.74 36.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.196 -0.94 . . . . 40.0 109.306 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.588 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -113.71 175.48 5.44 Favored 'General case' 0 C--N 1.31 -1.125 0 O-C-N 120.983 -1.073 . . . . 40.0 113.14 -178.715 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.544 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -161.44 139.29 9.18 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.654 -0.654 . . . . 40.0 110.584 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.637 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.17 154.42 39.81 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.5 -0.75 . . . . 40.0 110.232 -179.562 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.562 HG21 ' CE2' ' A' ' 7' ' ' PHE . 18.3 mm -138.11 152.61 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.174 -0.954 . . . . 40.0 109.381 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.514 HD22 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 56.64 56.29 5.68 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.04 0.447 . . . . 40.0 111.505 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.746 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 65.9 t80 -120.51 154.51 35.2 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.936 -1.102 . . . . 40.0 109.129 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.618 ' OG1' ' N ' ' A' ' 80' ' ' SER . 43.5 p -133.32 -79.49 0.48 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 122.036 0.922 . . . . 40.0 109.49 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.618 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.84 103.55 2.78 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 115.314 -0.857 . . . . 40.0 110.027 -179.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.79 -104.58 0.26 Allowed Glycine 0 N--CA 1.501 2.983 0 N-CA-C 108.713 -1.755 . . . . 40.0 108.713 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 15.3 t80 -125.93 -175.46 3.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.534 -0.98 . . . . 40.0 109.429 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.443 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.5 mtm180 -83.68 -149.94 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.804 . . . . 40.0 109.728 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.442 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.4 p30 -165.02 -134.19 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.108 -1.071 . . . . 40.0 108.108 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 29.9 p -116.0 -9.18 11.78 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.773 -1.204 . . . . 40.0 109.978 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.637 ' OD1' HG22 ' A' ' 100' ' ' THR . 23.9 m-20 -74.33 108.77 7.32 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 122.195 -0.316 . . . . 40.0 110.558 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.829 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.07 137.07 42.52 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.114 -0.991 . . . . 40.0 110.422 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.63 HD11 HG21 ' A' ' 96' ' ' ILE . 14.6 tt -106.98 146.51 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.411 0 CA-C-O 122.108 0.956 . . . . 40.0 110.858 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.54 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.8 mm? -124.32 129.78 51.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 40.0 108.808 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.648 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 21.8 p90 -132.65 142.03 48.91 Favored 'General case' 0 N--CA 1.515 2.792 0 N-CA-C 109.528 -0.545 . . . . 40.0 109.528 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.585 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.8 p -108.07 -178.71 3.69 Favored 'General case' 0 N--CA 1.506 2.349 0 CA-C-O 122.248 1.023 . . . . 40.0 113.109 -176.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.638 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.12 -52.66 57.96 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-O 122.502 1.144 . . . . 40.0 108.45 178.31 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.55 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -67.67 3.72 1.32 Allowed 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.348 -1.297 . . . . 40.0 110.116 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.484 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 73.2 m95 71.55 15.48 6.07 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.823 -0.548 . . . . 40.0 111.789 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 95' ' ' LEU . 21.0 mt -69.38 127.39 32.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.26 -1.525 . . . . 40.0 106.916 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.828 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mp -113.13 135.33 52.98 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 CA-C-O 122.824 1.297 . . . . 40.0 111.347 -177.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.543 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 14.0 m-85 -127.33 159.8 33.3 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.938 -1.504 . . . . 40.0 106.938 179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.456 ' NZ ' ' CZ ' ' A' ' 7' ' ' PHE . 4.5 ptmm? -128.45 142.8 50.98 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 119.028 -1.069 . . . . 40.0 112.731 -178.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 131.77 40.84 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 107.616 -1.253 . . . . 40.0 107.616 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.637 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.7 p -116.82 9.52 13.92 Favored 'General case' 0 N--CA 1.51 2.551 0 N-CA-C 109.699 -0.482 . . . . 40.0 109.699 -177.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.617 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -114.72 36.2 3.93 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.496 -0.882 . . . . 40.0 109.341 179.196 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.69 69.32 0.69 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.15 -0.968 . . . . 40.0 110.977 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 58.92 45.87 14.54 Favored 'General case' 0 C--N 1.299 -1.595 0 O-C-N 121.449 -0.782 . . . . 40.0 110.445 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.617 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 31.5 mm-40 -118.82 -78.73 0.59 Allowed 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.742 -1.224 . . . . 40.0 109.083 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.521 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.0 p -93.84 121.95 35.82 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 120.849 -1.157 . . . . 40.0 110.183 -178.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.543 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 5.7 m-85 -102.91 84.15 2.33 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.571 -0.706 . . . . 40.0 110.881 -179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 16.4 m -77.77 142.29 38.75 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 120.822 -1.174 . . . . 40.0 108.977 177.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.543 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 60.7 tttp -75.08 144.93 42.71 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.856 -0.528 . . . . 40.0 110.705 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.652 HD11 HG22 ' A' ' 96' ' ' ILE . 26.9 pt -127.49 -28.86 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 109.166 -0.679 . . . . 40.0 109.166 177.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.658 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.066 0 N-CA-C 108.861 -0.792 . . . . 40.0 108.861 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.685 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.0 t . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.347 -0.612 . . . . 40.0 109.347 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.604 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.7 mt -139.01 146.06 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.114 0 O-C-N 121.373 -0.83 . . . . 40.0 109.709 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.9 p-10 -147.52 32.88 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.089 -1.007 . . . . 40.0 109.765 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -118.87 140.94 49.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.949 0.88 . . . . 40.0 110.287 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.505 ' CE2' HG21 ' A' ' 76' ' ' ILE . 60.0 m-85 -41.17 -85.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 113.033 0.753 . . . . 40.0 113.033 -179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.642 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -48.37 -45.66 35.94 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.744 -0.598 . . . . 40.0 109.851 -178.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.74 -52.11 31.01 Favored Glycine 0 N--CA 1.495 2.613 0 N-CA-C 110.495 -1.042 . . . . 40.0 110.495 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 51.3 t -65.77 -45.08 92.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -1.211 . . . . 40.0 109.726 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 1.051 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.06 -56.98 15.03 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-O 121.626 0.727 . . . . 40.0 110.168 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.49 -49.58 67.19 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.965 -0.754 . . . . 40.0 108.965 178.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.633 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 16.6 t80 -51.85 -50.85 60.12 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.179 0.99 . . . . 40.0 109.02 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.56 HD22 ' HZ3' ' A' ' 94' ' ' TRP . 29.3 mt -66.37 -47.16 74.29 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 115.918 -0.583 . . . . 40.0 110.713 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.429 ' HG3' HD11 ' A' ' 96' ' ' ILE . 23.0 mt-30 -64.13 -21.67 66.64 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.196 -0.94 . . . . 40.0 111.531 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.2 m -105.11 -46.02 4.36 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 120.875 -1.14 . . . . 40.0 111.811 -178.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.577 ' C ' ' H ' ' A' ' 19' ' ' LYS . 79.5 m-85 -100.37 -17.12 17.38 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.145 -0.972 . . . . 40.0 110.919 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.559 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.5 m-70 61.97 -29.02 0.07 Allowed 'General case' 0 N--CA 1.505 2.3 0 CA-C-O 121.668 0.746 . . . . 40.0 111.282 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.633 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.47 115.96 12.36 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 120.93 -1.106 . . . . 40.0 108.741 179.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.647 HD23 ' HD2' ' A' ' 21' ' ' PRO . 0.9 OUTLIER -42.9 129.92 3.16 Favored Pre-proline 0 N--CA 1.5 2.029 0 N-CA-C 108.846 -0.798 . . . . 40.0 108.846 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.647 ' HD2' HD23 ' A' ' 20' ' ' LEU . 74.2 Cg_exo -35.47 134.82 0.21 Allowed 'Trans proline' 0 N--CA 1.49 1.319 0 C-N-CA 122.741 2.294 . . . . 40.0 112.94 -179.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.59 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -64.32 73.86 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 121.862 0.839 . . . . 40.0 110.302 -179.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.685 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 172.19 16.34 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.606 -0.684 . . . . 40.0 111.367 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.518 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 12.5 m-85 -113.57 164.64 13.39 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.311 -0.868 . . . . 40.0 111.034 -178.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -153.91 149.94 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.333 -0.855 . . . . 40.0 109.562 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.2 p -70.6 151.38 45.06 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.671 -0.643 . . . . 40.0 109.509 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.659 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -50.58 -51.76 45.35 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 107.715 -1.217 . . . . 40.0 107.715 177.226 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.9 t -47.14 -61.85 1.69 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.614 -0.679 . . . . 40.0 110.473 178.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -49.76 -57.13 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.089 -1.007 . . . . 40.0 108.939 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.48 -50.93 58.9 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-O 121.632 0.73 . . . . 40.0 109.656 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -64.34 -48.22 76.37 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.829 -0.544 . . . . 40.0 110.985 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.32 -31.08 70.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.259 -0.901 . . . . 40.0 109.957 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.8 -20.11 65.88 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.187 -0.945 . . . . 40.0 108.951 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.564 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 130.99 -1.89 5.5 Favored Glycine 0 N--CA 1.501 2.986 0 N-CA-C 110.863 -0.895 . . . . 40.0 110.863 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -60.07 116.52 4.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.585 -1.538 . . . . 40.0 109.034 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 43.2 t -123.88 143.7 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 CA-C-O 121.735 0.778 . . . . 40.0 110.523 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.8 77.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.244 -0.91 . . . . 40.0 109.812 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.9 p -79.16 51.08 1.13 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.86 -1.15 . . . . 40.0 109.06 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -173.3 -50.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 108.924 -0.769 . . . . 40.0 108.924 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.39 21.68 72.51 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 108.805 -1.718 . . . . 40.0 108.805 179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.564 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -56.79 132.02 51.04 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.85 -0.794 . . . . 40.0 109.059 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.565 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 6.1 tp -169.97 -57.2 0.02 OUTLIER 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.995 -1.113 . . . . 40.0 107.995 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.22 -23.75 49.96 Favored 'General case' 0 C--N 1.291 -1.966 0 O-C-N 121.683 -0.636 . . . . 40.0 110.768 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.425 ' OD2' HG13 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -76.86 -64.41 1.13 Allowed 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.709 -0.849 . . . . 40.0 108.709 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.425 HG13 ' OD2' ' A' ' 44' ' ' ASP . 27.5 m -68.87 -27.05 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.534 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -144.62 79.69 12.22 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.571 -0.705 . . . . 40.0 109.68 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -59.26 55.88 0.06 OUTLIER 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.713 2.275 . . . . 40.0 114.105 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.95 43.83 0.06 OUTLIER Glycine 0 N--CA 1.502 3.039 0 C-N-CA 120.104 -1.046 . . . . 40.0 111.152 178.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 19.2 tttt -122.89 146.18 47.8 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.771 -1.429 . . . . 40.0 109.585 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.6 m -116.21 136.97 52.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 40.0 109.808 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.429 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 7.4 mm -66.49 151.86 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 CA-C-O 121.241 0.543 . . . . 40.0 109.606 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 150.41 145.72 4.18 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 118.924 -1.607 . . . . 40.0 110.88 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 124.77 15.86 3.13 Favored Glycine 0 N--CA 1.494 2.56 0 O-C-N 121.305 -1.115 . . . . 40.0 111.388 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.659 ' CG ' ' HZ2' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -72.11 -169.65 0.52 Allowed 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.151 -1.205 . . . . 40.0 110.356 -179.801 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.401 HG12 ' C ' ' A' ' 54' ' ' ASP . 1.1 mm -133.49 138.14 51.61 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.62 0 CA-C-O 121.459 0.647 . . . . 40.0 109.627 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -150.41 146.84 26.93 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.426 -0.796 . . . . 40.0 109.63 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.686 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -91.16 -21.83 20.97 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.691 -0.631 . . . . 40.0 110.174 179.737 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.605 HD21 ' H ' ' A' ' 63' ' ' LEU . 64.6 t30 72.33 26.69 2.62 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.265 -0.897 . . . . 40.0 111.588 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.686 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.2 mtm-85 -55.32 -31.86 62.01 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.969 -1.082 . . . . 40.0 108.461 178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 20.2 mp0 -62.9 -10.48 13.58 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.063 -0.717 . . . . 40.0 109.063 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.27 45.42 96.51 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 110.402 -1.079 . . . . 40.0 110.402 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.649 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.28 -13.21 25.04 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.579 -0.953 . . . . 40.0 109.741 -179.785 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.615 HD21 ' CD2' ' A' ' 106' ' ' PHE . 24.7 mt -136.77 163.72 47.56 Favored Pre-proline 0 N--CA 1.494 1.747 0 N-CA-C 108.15 -1.056 . . . . 40.0 108.15 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.471 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 91.5 Cg_exo -42.62 141.59 2.31 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 122.449 2.099 . . . . 40.0 112.814 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.468 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.97 -171.02 12.71 Favored Glycine 0 N--CA 1.497 2.702 0 N-CA-C 110.788 -0.925 . . . . 40.0 110.788 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.439 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 ptmm? 177.09 -157.77 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.213 -1.403 . . . . 40.0 107.213 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' OG ' ' A' ' 67' ' ' SER . 53.1 p -75.08 84.91 2.32 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 107.134 -1.432 . . . . 40.0 107.134 177.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.439 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 80.91 99.33 0.35 Allowed Glycine 0 N--CA 1.497 2.726 0 N-CA-C 108.954 -1.658 . . . . 40.0 108.954 -178.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.606 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.1 tpp180 -121.14 142.68 49.64 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.587 -0.949 . . . . 40.0 110.175 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.638 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.99 128.66 55.14 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.341 -0.985 . . . . 40.0 108.341 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.531 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 34.5 m95 -120.54 142.3 49.46 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.062 -1.024 . . . . 40.0 110.814 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.594 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.2 mpp_? -141.22 146.89 37.47 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.462 -0.773 . . . . 40.0 109.986 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.641 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -116.72 169.84 9.05 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 121.184 -0.948 . . . . 40.0 111.983 -179.87 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.518 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -157.49 145.31 18.87 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.561 -0.712 . . . . 40.0 109.747 178.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.645 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.24 154.63 41.69 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.524 -0.735 . . . . 40.0 109.474 -178.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.505 HG21 ' CE2' ' A' ' 7' ' ' PHE . 15.0 mm -137.34 149.9 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.103 -0.998 . . . . 40.0 109.653 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.471 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.6 m-20 59.69 57.11 3.32 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-O 121.144 0.497 . . . . 40.0 111.016 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.565 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 60.6 t80 -121.51 153.83 37.44 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.17 -0.956 . . . . 40.0 109.025 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.61 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.0 p -132.29 -79.81 0.5 Allowed 'General case' 0 N--CA 1.5 2.03 0 CA-C-O 121.833 0.825 . . . . 40.0 109.937 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.61 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.99 99.92 2.59 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 108.723 -0.843 . . . . 40.0 108.723 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.17 -107.71 0.34 Allowed Glycine 0 N--CA 1.496 2.655 0 N-CA-C 109.953 -1.259 . . . . 40.0 109.953 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.471 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 19.5 t80 -123.43 -178.98 4.16 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.343 -1.093 . . . . 40.0 110.299 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.471 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -83.28 -153.45 0.13 Allowed 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.744 0.783 . . . . 40.0 110.306 -179.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.413 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.7 p30 -162.92 -133.66 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.356 -0.979 . . . . 40.0 108.356 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 100' ' ' THR . 52.9 p -115.39 -10.35 12.01 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.997 -1.064 . . . . 40.0 109.706 -179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.606 ' OD1' HG22 ' A' ' 100' ' ' THR . 14.1 m-20 -72.57 108.3 5.54 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 120.834 0.35 . . . . 40.0 110.078 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.789 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.02 137.61 41.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.124 -1.03 . . . . 40.0 110.502 -179.504 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.638 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.6 tt -107.99 148.01 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 122.509 1.147 . . . . 40.0 110.896 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.638 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -125.48 127.3 46.27 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.704 -0.85 . . . . 40.0 108.704 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.594 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.9 p90 -131.48 141.38 49.76 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.682 -0.858 . . . . 40.0 108.682 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.531 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 61.7 p -107.3 178.73 4.46 Favored 'General case' 0 N--CA 1.506 2.329 0 CA-C-O 122.114 0.959 . . . . 40.0 112.155 -177.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.638 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -50.7 -54.04 26.41 Favored 'General case' 0 N--CA 1.501 2.125 0 CA-C-O 122.37 1.081 . . . . 40.0 108.526 177.381 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.606 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -66.02 3.56 0.82 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.694 -1.139 . . . . 40.0 110.389 -179.153 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.56 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 64.9 m95 72.44 13.35 5.49 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.711 -0.618 . . . . 40.0 111.935 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.47 127.16 31.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 119.896 -1.752 . . . . 40.0 107.428 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 1.051 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mt -114.24 132.8 62.27 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.693 0 CA-C-O 122.552 1.168 . . . . 40.0 112.529 -177.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.487 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.4 m-85 -125.26 157.08 37.49 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 114.335 -1.302 . . . . 40.0 107.564 178.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.424 ' NZ ' ' CZ ' ' A' ' 7' ' ' PHE . 5.6 ptmm? -128.03 141.54 51.48 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.027 -1.069 . . . . 40.0 112.36 -177.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.423 ' HB ' ' O ' ' A' ' 105' ' ' THR . 0.0 OUTLIER -131.1 132.66 44.99 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 107.128 -1.434 . . . . 40.0 107.128 177.248 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.606 HG22 ' OD1' ' A' ' 86' ' ' ASP . 2.8 p -117.89 9.3 12.83 Favored 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 109.449 -0.574 . . . . 40.0 109.449 -178.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.531 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.63 35.11 4.19 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 119.672 -0.811 . . . . 40.0 109.765 179.16 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.13 68.05 0.76 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.21 -0.931 . . . . 40.0 111.036 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 60.53 42.57 14.04 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.793 -0.567 . . . . 40.0 110.778 178.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.531 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.9 mm-40 -114.63 -76.95 0.57 Allowed 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.732 -1.23 . . . . 40.0 109.655 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.486 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.0 p -93.83 126.03 38.79 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.622 -1.299 . . . . 40.0 110.669 -178.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.615 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.8 m-85 -105.85 85.98 2.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.593 -0.692 . . . . 40.0 110.807 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 12.5 m -77.89 144.87 36.57 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 119.25 -0.98 . . . . 40.0 108.793 177.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 58.8 tttp -77.21 147.92 36.15 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.609 -0.682 . . . . 40.0 110.151 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.747 HD11 ' CG2' ' A' ' 96' ' ' ILE . 23.2 pt -127.21 -35.46 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 N-CA-C 108.443 -0.947 . . . . 40.0 108.443 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.642 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.11 0 O-C-N 121.565 -0.709 . . . . 40.0 109.576 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.655 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.3 t . . . . . 0 N--CA 1.494 1.765 0 N-CA-C 109.132 -0.692 . . . . 40.0 109.132 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.571 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 9.5 mt -135.78 147.22 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.473 -0.767 . . . . 40.0 109.599 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -147.73 29.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.99 -1.068 . . . . 40.0 109.734 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.4 p -116.48 143.05 46.07 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 119.68 -0.808 . . . . 40.0 110.732 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.514 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 59.7 m-85 -42.95 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.372 0 N-CA-C 112.781 0.66 . . . . 40.0 112.781 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.622 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.0 OUTLIER -47.59 -47.23 28.72 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.583 -0.698 . . . . 40.0 110.135 -179.419 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.24 -50.91 38.4 Favored Glycine 0 N--CA 1.501 3.011 0 N-CA-C 110.52 -1.032 . . . . 40.0 110.52 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 39.2 t -65.58 -46.38 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.097 -1.237 . . . . 40.0 109.426 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.994 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.71 -57.1 13.88 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.417 -0.802 . . . . 40.0 110.246 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.08 -51.36 58.13 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 108.904 -0.776 . . . . 40.0 108.904 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.644 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.0 t80 -51.12 -49.93 59.82 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.969 0.89 . . . . 40.0 109.781 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.607 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 34.7 mt -68.25 -45.5 73.03 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.623 -0.673 . . . . 40.0 110.118 -179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.4 ' HG3' HD11 ' A' ' 96' ' ' ILE . 24.4 mt-30 -65.27 -19.12 65.82 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 119.387 -0.925 . . . . 40.0 111.744 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.9 m -107.52 -44.01 4.39 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.766 -1.209 . . . . 40.0 110.821 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.594 ' O ' ' N ' ' A' ' 19' ' ' LYS . 83.9 m-85 -104.52 -14.44 15.67 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 40.0 111.615 -177.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.607 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.3 m-70 59.54 -33.44 0.06 Allowed 'General case' 0 N--CA 1.51 2.549 0 CA-C-O 121.288 0.566 . . . . 40.0 111.483 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.644 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -68.68 120.85 15.32 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 120.758 -1.214 . . . . 40.0 108.233 179.481 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.541 ' HA ' HD21 ' A' ' 14' ' ' LEU . 3.4 mt -48.13 133.02 12.34 Favored Pre-proline 0 N--CA 1.504 2.229 0 O-C-N 121.335 -0.853 . . . . 40.0 109.398 -179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.458 ' O ' ' N ' ' A' ' 23' ' ' ASN . 78.7 Cg_exo -35.82 132.36 0.29 Allowed 'Trans proline' 0 C--N 1.313 -1.341 0 C-N-CA 122.732 2.288 . . . . 40.0 112.889 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.557 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.3 OUTLIER -63.48 74.8 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.955 0.883 . . . . 40.0 109.732 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.655 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 172.42 15.68 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.655 -0.653 . . . . 40.0 110.577 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -114.93 162.94 16.26 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.747 0.784 . . . . 40.0 111.095 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -149.38 151.4 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.086 -1.009 . . . . 40.0 109.698 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.477 HG22 ' O ' ' A' ' 53' ' ' GLY . 77.7 p -71.57 149.64 45.48 Favored 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 109.049 -0.723 . . . . 40.0 109.049 177.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.623 ' NZ ' ' OD2' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -48.77 -53.67 18.14 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.196 -1.039 . . . . 40.0 108.196 177.812 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.2 t -45.58 -63.19 1.01 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.739 -0.6 . . . . 40.0 110.415 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.436 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 44.5 mt-10 -49.42 -57.12 7.52 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.54 -0.725 . . . . 40.0 109.357 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.01 -48.49 70.38 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.324 -0.86 . . . . 40.0 109.91 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.408 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 57.0 mt-30 -64.43 -48.74 74.18 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.622 -0.674 . . . . 40.0 110.192 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.18 70.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 40.0 110.46 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mt -65.68 -20.35 66.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.288 -0.883 . . . . 40.0 109.209 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.566 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 132.73 -4.04 5.04 Favored Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.942 -1.123 . . . . 40.0 111.106 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -61.2 114.39 3.12 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.709 -1.465 . . . . 40.0 109.098 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.7 t -121.93 143.0 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-O 121.799 0.809 . . . . 40.0 110.626 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.08 -47.58 84.03 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.642 -0.661 . . . . 40.0 110.243 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.2 p -79.13 50.15 1.02 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.064 -1.022 . . . . 40.0 108.997 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 tttp -174.25 -51.55 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 109.115 -0.698 . . . . 40.0 109.115 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.63 23.76 75.4 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.566 ' ND2' ' O ' ' A' ' 34' ' ' GLY . 4.1 p-10 -56.51 130.11 43.64 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.838 -0.801 . . . . 40.0 108.967 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.663 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.4 tp -168.26 -60.05 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.997 -0.742 . . . . 40.0 108.997 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.424 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . . . -56.32 -23.64 38.44 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.312 -0.868 . . . . 40.0 109.808 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.51 -65.06 0.98 Allowed 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.916 -0.772 . . . . 40.0 108.916 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.49 -26.76 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-O 121.468 0.652 . . . . 40.0 109.553 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.517 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -144.65 78.64 12.88 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.32 -0.862 . . . . 40.0 109.873 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.424 ' HA ' ' HA ' ' A' ' 43' ' ' ALA . 20.0 Cg_exo -57.49 52.09 0.05 OUTLIER 'Trans proline' 0 N--CA 1.497 1.728 0 C-N-CA 122.847 2.364 . . . . 40.0 114.238 -178.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.34 42.92 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 C-N-CA 119.565 -1.302 . . . . 40.0 111.262 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.517 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 10.6 tttt -121.71 144.5 48.75 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.26 . . . . 40.0 109.996 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.0 m -116.25 132.18 56.74 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.177 -0.952 . . . . 40.0 109.941 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.483 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.8 mm -63.89 150.86 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.342 -0.849 . . . . 40.0 110.099 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 152.77 151.61 5.73 Favored Glycine 0 N--CA 1.502 3.048 0 C-N-CA 119.798 -1.191 . . . . 40.0 110.472 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.477 ' O ' HG22 ' A' ' 26' ' ' THR . . . 118.82 18.2 4.83 Favored Glycine 0 N--CA 1.497 2.709 0 O-C-N 121.177 -1.19 . . . . 40.0 110.865 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.623 ' OD2' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -75.78 -169.93 1.2 Allowed 'General case' 0 C--O 1.191 -1.987 0 O-C-N 121.182 -1.187 . . . . 40.0 109.537 179.768 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.8 mm -133.81 142.1 42.29 Favored 'Isoleucine or valine' 0 C--N 1.269 -2.906 0 CA-C-O 121.726 0.774 . . . . 40.0 109.945 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -154.51 146.85 23.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.696 -0.627 . . . . 40.0 109.53 179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.685 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -93.39 -19.38 21.37 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.431 -0.793 . . . . 40.0 110.874 -179.762 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.535 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.8 t30 69.15 30.14 4.45 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.115 -0.99 . . . . 40.0 111.825 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.685 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.86 -31.69 65.07 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.966 -1.084 . . . . 40.0 108.43 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.456 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 20.0 mp0 -63.47 -11.54 24.51 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 109.277 -0.638 . . . . 40.0 109.277 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 63.24 41.23 99.64 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.153 -1.179 . . . . 40.0 110.153 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.653 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -91.6 -13.81 31.3 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.446 -1.032 . . . . 40.0 109.157 179.706 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.535 ' H ' HD21 ' A' ' 58' ' ' ASN . 30.8 mt -135.72 163.37 51.01 Favored Pre-proline 0 N--CA 1.494 1.762 0 N-CA-C 108.579 -0.897 . . . . 40.0 108.579 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.631 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 85.4 Cg_exo -43.21 140.11 3.72 Favored 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 121.915 1.744 . . . . 40.0 112.239 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.619 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.16 -165.8 11.4 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.819 -1.312 . . . . 40.0 109.819 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.499 ' HB3' ' NH2' ' A' ' 69' ' ' ARG . 1.4 pttm 171.45 -154.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 107.6 -1.259 . . . . 40.0 107.6 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' A' ' 67' ' ' SER . 17.6 p -74.57 81.91 2.0 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 107.245 -1.391 . . . . 40.0 107.245 176.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.429 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.85 105.19 0.21 Allowed Glycine 0 N--CA 1.499 2.872 0 N-CA-C 108.762 -1.735 . . . . 40.0 108.762 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.621 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -126.53 141.52 51.84 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.654 -0.909 . . . . 40.0 110.155 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.641 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 27.8 p -108.71 130.13 55.36 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.955 -0.757 . . . . 40.0 108.955 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.631 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 33.5 m95 -121.78 146.24 47.25 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 119.522 -0.871 . . . . 40.0 110.895 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.54 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.8 OUTLIER -147.13 140.77 25.65 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.095 -1.003 . . . . 40.0 109.314 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -111.85 164.59 12.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.0 -1.062 . . . . 40.0 111.17 179.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.413 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . . . -151.41 147.12 26.5 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.693 -0.63 . . . . 40.0 109.62 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.639 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -70.51 155.8 40.23 Favored 'General case' 0 N--CA 1.51 2.563 0 O-C-N 121.097 -1.002 . . . . 40.0 110.583 -178.503 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.514 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 17.0 mm -139.19 151.81 23.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.255 -0.903 . . . . 40.0 110.147 179.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.566 HD22 ' CG ' ' A' ' 86' ' ' ASP . 67.9 m-20 57.96 53.88 6.49 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 121.311 0.577 . . . . 40.0 111.096 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.663 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 61.5 t80 -118.32 153.78 33.41 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.314 -0.866 . . . . 40.0 108.997 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.9 p -132.8 -79.09 0.49 Allowed 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 121.739 0.781 . . . . 40.0 109.765 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.26 101.83 2.72 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 109.387 -0.597 . . . . 40.0 109.387 -178.918 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -104.99 0.27 Allowed Glycine 0 N--CA 1.5 2.913 0 N-CA-C 109.643 -1.383 . . . . 40.0 109.643 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.478 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 23.1 t80 -125.85 -178.0 4.13 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.522 -0.987 . . . . 40.0 109.882 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.478 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 3.0 mtm180 -83.55 -152.02 0.12 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.43 -0.793 . . . . 40.0 110.456 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.421 HD21 ' HB2' ' A' ' 86' ' ' ASP . 38.4 p-10 -164.01 -132.58 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.686 -0.857 . . . . 40.0 108.686 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 100' ' ' THR . 15.4 p -116.48 -9.63 11.4 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.199 -0.938 . . . . 40.0 109.575 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.65 ' OD1' HG22 ' A' ' 100' ' ' THR . 12.6 m-20 -75.01 108.99 8.1 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-N 116.4 -0.364 . . . . 40.0 110.758 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.824 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.57 140.14 44.42 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.232 -0.917 . . . . 40.0 110.395 179.393 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.662 ' O ' HD22 ' A' ' 89' ' ' LEU . 11.8 tt -108.57 148.98 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-O 122.533 1.159 . . . . 40.0 110.341 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.662 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.9 mm? -126.94 124.65 39.99 Favored 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 108.431 -0.951 . . . . 40.0 108.431 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.3 p90 -128.36 141.38 51.44 Favored 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 108.968 -0.753 . . . . 40.0 108.968 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.573 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 59.4 p -107.51 -178.4 3.62 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.083 -1.01 . . . . 40.0 112.017 -176.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.641 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -53.58 -55.81 22.54 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.403 1.097 . . . . 40.0 108.34 177.464 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.621 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -64.63 5.28 0.31 Allowed 'General case' 0 C--N 1.291 -1.94 0 CA-C-N 114.419 -1.264 . . . . 40.0 110.388 -179.187 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.469 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 66.3 m95 70.46 14.65 7.36 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.74 -0.6 . . . . 40.0 111.856 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 95' ' ' LEU . 26.8 mt -68.42 127.89 34.6 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 119.66 -1.9 . . . . 40.0 106.719 177.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.994 HD13 ' HB1' ' A' ' 11' ' ' ALA . 3.0 mt -115.96 134.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 CA-C-O 122.803 1.287 . . . . 40.0 111.602 -177.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.429 ' CE1' ' HG2' ' A' ' 64' ' ' PRO . 13.9 m-85 -126.91 157.22 39.98 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.269 -1.382 . . . . 40.0 107.269 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.435 ' NZ ' ' HB2' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.3 144.75 50.99 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 118.929 -1.108 . . . . 40.0 112.39 -178.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.425 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.17 132.68 38.28 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.772 -1.195 . . . . 40.0 107.772 177.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.65 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.2 p -117.87 9.2 12.82 Favored 'General case' 0 N--CA 1.504 2.269 0 CA-C-O 120.91 0.386 . . . . 40.0 109.973 -177.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.602 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.99 33.18 5.38 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.768 -0.773 . . . . 40.0 109.973 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 63.17 70.13 0.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.975 -1.078 . . . . 40.0 110.362 178.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 56.49 48.33 16.99 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.52 -0.737 . . . . 40.0 109.835 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.602 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 27.3 mm-40 -120.0 -77.71 0.58 Allowed 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.724 -1.235 . . . . 40.0 109.339 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.557 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 17.7 p -94.78 120.58 35.23 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.724 -1.235 . . . . 40.0 110.155 -178.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.512 ' N ' ' CD1' ' A' ' 106' ' ' PHE . 5.7 m-85 -102.28 86.4 2.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.417 -0.802 . . . . 40.0 110.545 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.4 m -79.13 146.9 32.92 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.199 -0.938 . . . . 40.0 109.036 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.503 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 58.0 tttp -78.04 146.87 35.05 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.796 -0.565 . . . . 40.0 110.41 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.741 HD11 ' CG2' ' A' ' 96' ' ' ILE . 22.4 pt -128.98 -32.0 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 N-CA-C 109.126 -0.694 . . . . 40.0 109.126 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.622 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 108.493 -0.929 . . . . 40.0 108.493 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.687 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.6 t . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.647 -0.501 . . . . 40.0 109.647 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.531 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -137.88 148.93 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.243 -0.911 . . . . 40.0 109.065 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 52.0 p-10 -149.05 34.03 0.74 Allowed 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.209 -0.932 . . . . 40.0 109.798 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 24.4 p -120.09 142.91 48.45 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 119.635 -0.826 . . . . 40.0 110.56 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.584 ' CE2' HG21 ' A' ' 76' ' ' ILE . 68.8 m-85 -43.28 -84.98 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.32 0 CA-C-O 121.952 0.882 . . . . 40.0 112.573 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.629 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.6 OUTLIER -45.82 -47.56 15.8 Favored 'General case' 0 C--N 1.283 -2.298 0 O-C-N 121.853 -0.529 . . . . 40.0 110.035 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.62 -49.92 50.96 Favored Glycine 0 N--CA 1.502 3.048 0 N-CA-C 110.331 -1.108 . . . . 40.0 110.331 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -66.17 -43.97 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.224 -1.162 . . . . 40.0 108.562 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.84 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.86 -58.33 8.62 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.252 -0.905 . . . . 40.0 109.388 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.05 -49.38 63.58 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.368 0.604 . . . . 40.0 109.605 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.612 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 13.6 t80 -53.67 -48.96 68.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.011 0.91 . . . . 40.0 109.65 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.578 HD21 ' HA ' ' A' ' 20' ' ' LEU . 29.9 mt -69.63 -46.12 66.93 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.805 -0.559 . . . . 40.0 110.658 -178.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -64.72 -22.11 66.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.429 -0.794 . . . . 40.0 110.875 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.7 m -103.25 -43.89 5.33 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.643 -1.286 . . . . 40.0 111.851 -178.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.558 ' O ' ' N ' ' A' ' 19' ' ' LYS . 86.2 m-85 -107.51 -12.6 15.26 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.168 -0.957 . . . . 40.0 111.005 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.54 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 60.56 -30.9 0.06 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.975 -0.453 . . . . 40.0 111.817 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.612 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -69.69 117.48 11.34 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.936 -1.103 . . . . 40.0 108.583 179.254 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.578 ' HA ' HD21 ' A' ' 14' ' ' LEU . 3.3 mt -44.92 131.75 5.26 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.476 -0.765 . . . . 40.0 109.151 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.509 ' HD2' HD23 ' A' ' 20' ' ' LEU . 71.3 Cg_exo -34.59 132.72 0.17 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.782 2.321 . . . . 40.0 112.549 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.561 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -63.49 74.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.59 0.709 . . . . 40.0 110.479 -179.313 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.687 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 172.37 18.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.578 -0.701 . . . . 40.0 110.681 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -116.57 160.96 19.9 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.52 -0.738 . . . . 40.0 110.978 -178.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.52 152.58 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.249 -0.907 . . . . 40.0 109.151 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.456 HG22 ' O ' ' A' ' 53' ' ' GLY . 72.9 p -71.5 151.01 44.3 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 121.367 0.603 . . . . 40.0 110.093 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -50.67 -51.75 46.37 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.74 -1.207 . . . . 40.0 107.74 177.251 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.9 t -47.13 -62.13 1.56 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.282 -0.886 . . . . 40.0 110.232 178.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -48.53 -58.67 4.33 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.288 -0.883 . . . . 40.0 109.162 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.26 -49.42 61.22 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 121.562 0.696 . . . . 40.0 110.067 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -65.07 -50.09 67.49 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.371 0.605 . . . . 40.0 110.32 -179.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.1 -30.36 70.36 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.434 -0.791 . . . . 40.0 110.16 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.9 mt -68.22 -19.69 64.77 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 40.0 109.215 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.537 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.85 -2.19 5.18 Favored Glycine 0 N--CA 1.5 2.922 0 C-N-CA 119.847 -1.168 . . . . 40.0 111.221 178.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -62.56 113.79 3.17 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.697 -1.472 . . . . 40.0 109.047 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.0 t -121.69 144.91 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 40.0 110.012 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.79 85.56 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.442 -0.786 . . . . 40.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.2 p -79.18 52.17 1.27 Allowed 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.266 -1.013 . . . . 40.0 108.266 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -174.83 -52.26 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 109.261 -0.644 . . . . 40.0 109.261 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.65 22.94 76.88 Favored Glycine 0 N--CA 1.5 2.954 0 N-CA-C 109.38 -1.488 . . . . 40.0 109.38 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.537 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.0 p-10 -59.78 126.51 27.86 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.58 -0.953 . . . . 40.0 110.304 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.504 HD11 HD11 ' A' ' 51' ' ' ILE . 0.9 OUTLIER -165.53 -57.59 0.03 OUTLIER 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.552 -0.907 . . . . 40.0 108.552 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.463 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . . . -53.93 -29.14 41.04 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.264 -0.897 . . . . 40.0 109.865 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -63.0 1.37 Allowed 'General case' 0 N--CA 1.504 2.228 0 CA-C-O 121.553 0.692 . . . . 40.0 109.732 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.6 m -71.1 -23.76 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.409 -0.807 . . . . 40.0 110.403 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.606 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.78 76.38 9.75 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.153 -0.967 . . . . 40.0 109.461 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 43' ' ' ALA . 2.8 Cg_exo -61.82 57.28 0.12 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 C-N-CA 122.213 1.942 . . . . 40.0 113.097 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 146.62 36.18 0.06 OUTLIER Glycine 0 N--CA 1.504 3.179 0 N-CA-C 110.71 -0.956 . . . . 40.0 110.71 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.606 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 9.4 tttt -118.48 144.14 46.22 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.724 -1.457 . . . . 40.0 109.995 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.8 m -117.02 134.36 54.85 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.217 -0.927 . . . . 40.0 109.314 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.504 HD11 HD11 ' A' ' 42' ' ' LEU . 8.7 mm -65.01 148.41 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.925 0 CA-C-O 121.675 0.75 . . . . 40.0 109.719 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.81 145.34 4.12 Favored Glycine 0 N--CA 1.494 2.529 0 C-N-CA 119.002 -1.57 . . . . 40.0 111.151 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.456 ' O ' HG22 ' A' ' 26' ' ' THR . . . 124.14 17.52 3.0 Favored Glycine 0 N--CA 1.494 2.564 0 C-N-CA 119.986 -1.102 . . . . 40.0 111.11 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.565 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -73.33 -166.58 0.34 Allowed 'General case' 0 C--O 1.196 -1.713 0 O-C-N 120.844 -1.386 . . . . 40.0 109.908 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -134.72 140.48 45.5 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.688 0 CA-C-O 121.555 0.693 . . . . 40.0 109.826 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -152.26 146.35 25.35 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.542 -0.724 . . . . 40.0 109.727 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.679 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.23 -18.37 21.75 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.497 -0.752 . . . . 40.0 110.529 -179.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.603 HD21 ' H ' ' A' ' 63' ' ' LEU . 63.3 t30 69.3 29.04 4.67 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.113 -0.992 . . . . 40.0 111.633 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.679 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.5 mtm-85 -56.45 -30.83 63.35 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.039 -1.038 . . . . 40.0 108.213 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.442 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 24.5 mp0 -64.75 -10.3 26.6 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.369 -0.604 . . . . 40.0 109.369 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.29 44.89 97.03 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.031 -1.228 . . . . 40.0 110.031 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.667 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -94.95 -13.16 25.6 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.603 -0.939 . . . . 40.0 109.249 -179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.623 HD21 ' CD2' ' A' ' 106' ' ' PHE . 24.3 mt -135.18 164.05 46.63 Favored Pre-proline 0 N--CA 1.492 1.634 0 N-CA-C 108.378 -0.971 . . . . 40.0 108.378 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.546 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 94.8 Cg_exo -44.08 138.13 6.82 Favored 'Trans proline' 0 N--CA 1.495 1.595 0 C-N-CA 121.83 1.687 . . . . 40.0 112.006 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.608 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.15 -167.4 11.94 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 110.205 -1.158 . . . . 40.0 110.205 -178.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.514 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.2 pttm 173.7 -158.67 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.15 -1.426 . . . . 40.0 107.15 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.46 ' O ' ' OG ' ' A' ' 67' ' ' SER . 32.6 p -73.6 92.29 1.93 Allowed 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.371 -1.344 . . . . 40.0 107.371 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.514 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.1 98.99 0.11 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.116 -1.593 . . . . 40.0 109.116 -178.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.608 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.9 tpp180 -124.49 138.79 54.31 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.7 -0.882 . . . . 40.0 109.587 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.596 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 22.4 p -106.79 130.64 54.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.5 -0.926 . . . . 40.0 108.5 179.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.573 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 30.6 m95 -122.43 145.49 48.24 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.379 -0.826 . . . . 40.0 110.545 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.552 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.0 OUTLIER -142.95 145.36 32.93 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.289 -0.882 . . . . 40.0 109.583 -179.236 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -114.8 166.44 11.76 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.09 -1.006 . . . . 40.0 111.557 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.402 ' O ' HG22 ' A' ' 88' ' ' ILE . . . -156.02 143.6 19.42 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.275 -0.891 . . . . 40.0 110.371 178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.658 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.3 OUTLIER -66.87 153.38 43.62 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.313 -0.867 . . . . 40.0 111.188 -178.79 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.584 HG21 ' CE2' ' A' ' 7' ' ' PHE . 18.7 mm -136.98 153.5 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.393 -0.817 . . . . 40.0 109.799 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.499 HD22 ' CG ' ' A' ' 86' ' ' ASP . 74.8 m-20 56.44 51.62 11.13 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.064 0.459 . . . . 40.0 111.872 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.475 ' CG ' ' N ' ' A' ' 79' ' ' THR . 59.3 t80 -117.39 154.01 32.06 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.126 -0.983 . . . . 40.0 109.323 178.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.65 ' OG1' ' N ' ' A' ' 80' ' ' SER . 31.4 p -131.97 -79.61 0.51 Allowed 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.058 0.932 . . . . 40.0 109.424 178.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.65 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -150.89 106.0 3.33 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.773 -0.825 . . . . 40.0 108.773 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 150.76 -107.79 0.36 Allowed Glycine 0 N--CA 1.499 2.883 0 N-CA-C 109.803 -1.319 . . . . 40.0 109.803 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.444 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.7 t80 -125.08 -177.97 4.03 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.345 -1.091 . . . . 40.0 109.376 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.444 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.4 mtm180 -82.6 -151.74 0.1 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.418 -0.801 . . . . 40.0 110.37 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.452 HD21 ' HB2' ' A' ' 77' ' ' ASN . 36.8 p30 -163.92 -134.21 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.253 -1.017 . . . . 40.0 108.253 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 100' ' ' THR . 53.3 p -116.02 -9.05 11.79 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 120.891 -1.131 . . . . 40.0 109.621 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.631 ' OD1' HG22 ' A' ' 100' ' ' THR . 19.7 m-20 -74.45 109.53 8.01 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 120.798 0.333 . . . . 40.0 110.414 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.804 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.45 139.9 44.45 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 119.521 -0.872 . . . . 40.0 109.951 179.31 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.649 ' O ' HD22 ' A' ' 89' ' ' LEU . 18.9 tt -108.79 149.1 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-O 122.403 1.096 . . . . 40.0 110.117 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.649 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.9 mm? -125.74 127.21 45.83 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.355 -0.841 . . . . 40.0 109.026 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.552 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.0 p90 -129.93 140.65 50.9 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.492 -0.558 . . . . 40.0 109.492 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.573 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.5 p -105.4 -178.07 3.55 Favored 'General case' 0 N--CA 1.505 2.29 0 CA-C-O 122.27 1.033 . . . . 40.0 112.73 -177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.596 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -56.2 -50.54 70.95 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-O 122.205 1.003 . . . . 40.0 108.645 178.039 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.539 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -70.25 4.95 1.91 Allowed 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 114.656 -1.157 . . . . 40.0 110.234 -178.85 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.513 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 69.7 m95 72.21 17.4 4.99 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.848 -0.532 . . . . 40.0 111.474 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 95' ' ' LEU . 18.8 mt -72.04 125.83 28.24 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.901 -1.518 . . . . 40.0 106.901 177.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.84 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.4 mp -112.97 133.54 58.48 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 CA-C-O 122.798 1.285 . . . . 40.0 111.975 -177.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.577 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 13.3 m-85 -126.14 158.52 35.31 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.402 -1.333 . . . . 40.0 107.402 178.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.4 ' HD2' ' CG2' ' A' ' 109' ' ' ILE . 6.1 ptmm? -126.79 143.75 51.16 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.642 -1.223 . . . . 40.0 112.462 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.421 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.9 129.62 36.63 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.521 -1.289 . . . . 40.0 107.521 177.494 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.631 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.7 p -115.6 9.47 15.34 Favored 'General case' 0 N--CA 1.513 2.694 0 N-CA-C 109.718 -0.475 . . . . 40.0 109.718 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.592 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.1 35.18 4.45 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 119.799 -0.76 . . . . 40.0 109.36 179.183 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.2 68.76 0.74 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.383 -0.823 . . . . 40.0 111.168 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 62.07 40.37 12.12 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.47 -0.769 . . . . 40.0 110.657 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.592 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.2 mm-40 -114.39 -76.14 0.58 Allowed 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.749 -1.219 . . . . 40.0 110.002 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.546 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 27.5 p -95.13 124.0 38.93 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 120.706 -1.246 . . . . 40.0 110.068 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.623 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.7 m-85 -104.44 84.71 2.23 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.475 -0.765 . . . . 40.0 110.891 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.35 145.42 35.26 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.954 -1.091 . . . . 40.0 108.948 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.577 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 59.1 tttp -76.84 143.72 39.54 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.972 -0.455 . . . . 40.0 110.193 -179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.729 HD11 HG22 ' A' ' 96' ' ' ILE . 36.8 pt -127.45 -31.4 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 109.446 -0.576 . . . . 40.0 109.446 178.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.629 HH22 ' CG ' ' A' ' 8' ' ' ASP . 1.4 mmt-85 . . . . . 0 N--CA 1.504 2.241 0 N-CA-C 109.157 -0.683 . . . . 40.0 109.157 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.704 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.1 t . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 121.003 0.43 . . . . 40.0 109.983 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.574 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.0 mt -138.02 148.62 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.288 -0.883 . . . . 40.0 109.824 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -149.24 32.62 0.74 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.265 -0.897 . . . . 40.0 109.515 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 37.9 p -118.65 139.23 51.85 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.782 0.801 . . . . 40.0 110.314 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.507 ' CE2' HG21 ' A' ' 76' ' ' ILE . 55.9 m-85 -40.62 -87.95 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 122.291 1.043 . . . . 40.0 113.367 -178.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.661 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.5 OUTLIER -44.13 -48.78 9.13 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 115.734 -0.666 . . . . 40.0 109.877 -179.042 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -51.48 -50.49 41.54 Favored Glycine 0 N--CA 1.499 2.894 0 N-CA-C 110.298 -1.121 . . . . 40.0 110.298 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.7 t -65.42 -46.32 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.019 -1.283 . . . . 40.0 109.099 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 1.027 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -55.17 -57.89 9.9 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.573 0.701 . . . . 40.0 110.119 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.21 -49.72 63.34 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.681 -0.637 . . . . 40.0 109.672 178.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.592 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 18.5 t80 -51.65 -50.17 60.87 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.312 1.053 . . . . 40.0 108.605 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.634 HD21 ' HA ' ' A' ' 20' ' ' LEU . 25.6 mt -69.28 -45.12 70.41 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.592 -0.731 . . . . 40.0 111.006 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.402 ' HG3' HD11 ' A' ' 96' ' ' ILE . 16.8 mt-30 -65.08 -21.61 66.84 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 40.0 110.926 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.9 m -103.09 -44.7 5.14 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.015 -1.053 . . . . 40.0 111.56 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.574 ' C ' ' H ' ' A' ' 19' ' ' LYS . 88.9 m-85 -105.53 -13.63 15.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.129 -0.982 . . . . 40.0 111.42 -177.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.573 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 59.77 -26.71 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 121.303 0.573 . . . . 40.0 111.759 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.592 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -72.65 117.92 14.93 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 120.494 -1.379 . . . . 40.0 108.886 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.634 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -45.84 128.44 6.89 Favored Pre-proline 0 C--N 1.296 -1.74 0 O-C-N 121.328 -0.858 . . . . 40.0 109.461 -179.571 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.55 ' HD2' HD23 ' A' ' 20' ' ' LEU . 75.1 Cg_exo -34.11 133.31 0.14 Allowed 'Trans proline' 0 N--CA 1.489 1.251 0 C-N-CA 122.976 2.451 . . . . 40.0 112.988 -179.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.575 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.1 OUTLIER -64.78 75.75 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.806 0.812 . . . . 40.0 110.791 -178.827 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.704 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.1 p-10 171.83 16.05 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.862 -0.523 . . . . 40.0 110.919 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.498 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 13.4 m-85 -113.06 167.42 10.54 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.432 -0.793 . . . . 40.0 111.353 -179.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -158.16 150.89 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.067 -1.021 . . . . 40.0 108.801 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.3 p -69.7 154.23 42.27 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.384 0.611 . . . . 40.0 109.548 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.643 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -53.29 -50.72 64.3 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.148 -1.427 . . . . 40.0 107.148 176.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -47.65 -62.13 1.6 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.51 -0.744 . . . . 40.0 110.544 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -49.05 -57.61 6.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.347 -0.845 . . . . 40.0 109.172 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.9 -49.99 61.92 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.581 -0.699 . . . . 40.0 109.71 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.405 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 51.4 mt-30 -64.05 -50.07 69.85 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.689 -0.632 . . . . 40.0 110.762 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.89 -32.79 74.28 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.429 -0.794 . . . . 40.0 109.953 -179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mt -64.89 -20.68 66.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.268 -0.895 . . . . 40.0 109.334 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.548 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.49 -2.02 5.31 Favored Glycine 0 N--CA 1.498 2.767 0 N-CA-C 110.668 -0.973 . . . . 40.0 110.668 179.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -59.97 114.01 2.6 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.73 -1.453 . . . . 40.0 109.299 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.27 143.44 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.125 0 CA-C-O 121.926 0.869 . . . . 40.0 111.168 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -63.34 -48.3 78.57 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.797 -0.564 . . . . 40.0 110.392 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.5 p -79.32 52.08 1.3 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.016 -1.053 . . . . 40.0 108.452 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -175.49 -52.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.095 -0.706 . . . . 40.0 109.095 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.22 18.14 76.43 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.804 -1.718 . . . . 40.0 108.804 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.548 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -52.96 130.35 33.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.943 -0.739 . . . . 40.0 109.905 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.637 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 3.7 tp -169.34 -57.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.517 -0.92 . . . . 40.0 108.517 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.68 -25.36 53.82 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.231 -0.918 . . . . 40.0 109.934 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.87 -60.05 2.53 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.122 -0.695 . . . . 40.0 109.122 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.2 m -74.27 -22.46 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.527 -0.733 . . . . 40.0 109.64 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.613 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.77 78.78 8.88 Favored Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 121.11 -0.994 . . . . 40.0 109.339 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -56.24 50.55 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.825 0 C-N-CA 123.311 2.674 . . . . 40.0 113.998 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.547 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.17 0.06 OUTLIER Glycine 0 N--CA 1.504 3.175 0 C-N-CA 119.911 -1.138 . . . . 40.0 111.047 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.613 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 18.6 tttt -120.14 145.59 46.79 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 120.906 -1.349 . . . . 40.0 109.662 179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 14.8 m -116.61 136.3 53.09 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.306 -0.871 . . . . 40.0 109.642 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.508 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 4.9 mm -69.63 153.79 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.315 -0.866 . . . . 40.0 110.223 -179.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.77 143.98 3.83 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 119.048 -1.548 . . . . 40.0 110.401 179.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 128.88 13.2 2.5 Favored Glycine 0 N--CA 1.496 2.636 0 C-N-CA 119.495 -1.336 . . . . 40.0 111.217 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.617 ' CG ' ' HZ1' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -73.99 -172.83 1.43 Allowed 'General case' 0 C--O 1.195 -1.804 0 O-C-N 120.904 -1.35 . . . . 40.0 110.84 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.48 143.74 40.06 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.603 0 CA-C-O 121.701 0.762 . . . . 40.0 110.173 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -155.94 147.2 22.53 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.31 -0.868 . . . . 40.0 109.54 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.717 ' HG ' HH12 ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.19 -16.6 24.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.739 -0.601 . . . . 40.0 110.636 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 65.9 t30 66.19 28.09 10.17 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.17 -0.956 . . . . 40.0 111.72 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.717 HH12 ' HG ' ' A' ' 57' ' ' SER . 1.1 mtm-85 -56.45 -31.06 63.62 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.023 -1.048 . . . . 40.0 108.384 178.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 17.4 mp0 -61.93 -12.1 16.46 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.903 -0.777 . . . . 40.0 108.903 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.55 40.44 99.13 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 110.003 -1.239 . . . . 40.0 110.003 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.581 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -93.99 -10.51 33.37 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.828 -0.807 . . . . 40.0 109.23 179.624 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.521 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 36.9 mt -135.62 162.64 55.92 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 108.032 -1.099 . . . . 40.0 108.032 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.647 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 97.3 Cg_exo -44.79 139.52 7.54 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 121.536 1.491 . . . . 40.0 112.298 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.497 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.94 -169.58 12.49 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 110.361 -1.096 . . . . 40.0 110.361 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.472 ' HB3' ' NH2' ' A' ' 69' ' ' ARG . 3.4 pttm 175.35 -156.66 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.924 -1.51 . . . . 40.0 106.924 -179.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.428 ' O ' ' OG ' ' A' ' 67' ' ' SER . 59.5 p -74.41 84.54 1.97 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.546 -1.279 . . . . 40.0 107.546 178.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.42 102.82 0.2 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 108.417 -1.873 . . . . 40.0 108.417 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.566 HH11 ' CG ' ' A' ' 93' ' ' ASP . 15.6 tpp180 -125.51 141.55 51.98 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.869 -0.783 . . . . 40.0 109.55 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.624 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 25.5 p -108.88 131.31 55.13 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.741 -0.837 . . . . 40.0 108.741 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.647 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 36.2 m95 -121.91 147.97 45.34 Favored 'General case' 0 N--CA 1.5 2.047 0 C-N-CA 119.453 -0.899 . . . . 40.0 111.014 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.589 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.3 mpp_? -146.02 144.72 30.26 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.183 -0.948 . . . . 40.0 109.676 -178.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.643 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.09 165.55 13.01 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.146 -0.971 . . . . 40.0 111.515 179.558 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.498 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -152.16 147.5 26.5 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.504 -0.748 . . . . 40.0 109.574 178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.685 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -71.38 150.77 44.71 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.592 -0.693 . . . . 40.0 110.244 -179.061 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.507 HG21 ' CE2' ' A' ' 7' ' ' PHE . 15.5 mm -134.66 150.59 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 40.0 109.916 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.528 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.7 m-20 58.26 60.15 2.76 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-O 121.235 0.541 . . . . 40.0 111.485 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.637 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 66.2 t80 -123.87 154.28 39.89 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.103 -0.998 . . . . 40.0 109.385 178.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.602 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.0 p -132.19 -80.38 0.5 Allowed 'General case' 0 N--CA 1.502 2.154 0 CA-C-O 121.719 0.771 . . . . 40.0 110.005 179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.602 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.16 102.01 2.75 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 109.167 -0.679 . . . . 40.0 109.167 -179.107 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.88 -104.32 0.26 Allowed Glycine 0 N--CA 1.5 2.965 0 N-CA-C 109.833 -1.307 . . . . 40.0 109.833 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.451 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.8 t80 -125.79 -178.42 4.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.47 -1.018 . . . . 40.0 109.934 178.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.456 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 3.7 mtm180 -83.86 -151.88 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.655 -0.653 . . . . 40.0 110.425 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.511 HD21 ' HB2' ' A' ' 86' ' ' ASP . 47.7 p-10 -164.7 -136.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.851 -0.796 . . . . 40.0 108.851 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.459 ' OG ' ' O ' ' A' ' 100' ' ' THR . 22.4 p -113.13 -11.85 13.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.993 -1.067 . . . . 40.0 109.871 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.572 ' OD1' HG22 ' A' ' 100' ' ' THR . 11.8 m-20 -71.79 109.17 5.49 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 120.964 0.412 . . . . 40.0 110.518 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.831 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.85 140.55 44.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.533 -0.729 . . . . 40.0 110.025 179.657 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.695 ' O ' HD22 ' A' ' 89' ' ' LEU . 13.9 tt -111.23 149.93 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 CA-C-O 122.375 1.084 . . . . 40.0 109.757 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.695 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -127.18 127.54 44.67 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 109.326 -0.62 . . . . 40.0 109.326 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.589 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.6 p90 -131.65 141.76 49.69 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 109.116 -0.698 . . . . 40.0 109.116 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.536 ' HB3' ' CE2' ' A' ' 71' ' ' TRP . 64.3 p -107.61 -179.86 4.03 Favored 'General case' 0 N--CA 1.505 2.287 0 CA-C-O 122.22 1.01 . . . . 40.0 112.418 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.624 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.77 -50.54 63.34 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 122.35 1.072 . . . . 40.0 108.636 178.508 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.566 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 3.83 1.84 Allowed 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.598 -1.183 . . . . 40.0 110.241 -179.145 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.535 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 78.5 m95 72.53 13.59 5.36 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.764 -0.585 . . . . 40.0 111.758 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 95' ' ' LEU . 21.1 mt -70.01 128.9 37.94 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 119.819 -1.8 . . . . 40.0 107.562 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 1.027 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.5 mt -114.59 135.54 54.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.774 0 CA-C-O 122.707 1.241 . . . . 40.0 112.527 -176.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.559 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.8 m-85 -127.75 156.49 42.35 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.377 -1.342 . . . . 40.0 107.377 179.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.464 ' NZ ' ' HB2' ' A' ' 98' ' ' LYS . 4.7 ptmm? -125.31 143.64 50.87 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 118.758 -1.177 . . . . 40.0 112.73 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.408 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -134.84 132.09 38.19 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.233 -1.395 . . . . 40.0 107.233 177.722 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.572 HG22 ' OD1' ' A' ' 86' ' ' ASP . 4.0 p -117.9 11.56 13.51 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 109.566 -0.531 . . . . 40.0 109.566 -177.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.604 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -116.32 32.97 5.8 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 119.902 -0.719 . . . . 40.0 109.798 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 64.37 66.62 0.61 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.012 -1.055 . . . . 40.0 111.03 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 60.76 43.2 12.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.266 -0.896 . . . . 40.0 110.472 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.604 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.6 mm-40 -116.37 -76.81 0.57 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.621 -1.299 . . . . 40.0 109.104 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.544 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 25.9 p -94.25 122.27 36.61 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.67 -1.269 . . . . 40.0 109.785 -178.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.55 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 4.9 m-85 -104.11 84.73 2.27 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.54 -0.725 . . . . 40.0 110.972 -179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.8 m -77.9 144.51 36.84 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 120.916 -1.115 . . . . 40.0 109.314 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.572 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 60.5 tttp -75.83 147.72 38.93 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.41 -0.806 . . . . 40.0 110.592 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.81 HD11 HG22 ' A' ' 96' ' ' ILE . 38.8 pt -129.81 -31.14 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 109.223 -0.658 . . . . 40.0 109.223 178.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.661 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.15 0 CA-C-O 118.514 -0.755 . . . . 40.0 109.097 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.678 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 109.917 -0.401 . . . . 40.0 109.917 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.582 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.7 mt -140.13 147.79 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 40.0 109.068 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.0 p-10 -149.98 35.03 0.67 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.072 -1.017 . . . . 40.0 109.454 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 30.6 p -119.76 144.07 47.47 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 119.577 -0.849 . . . . 40.0 110.512 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.507 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 62.0 m-85 -45.23 -85.56 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.714 0 N-CA-C 113.471 0.915 . . . . 40.0 113.471 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.642 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.14 -46.26 17.08 Favored 'General case' 0 C--N 1.288 -2.071 0 O-C-N 121.623 -0.673 . . . . 40.0 110.117 -179.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.03 60.45 Favored Glycine 0 N--CA 1.499 2.895 0 N-CA-C 110.732 -0.947 . . . . 40.0 110.732 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.6 t -66.84 -42.11 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.019 -1.283 . . . . 40.0 108.29 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.909 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -60.51 -55.4 33.88 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.961 -1.087 . . . . 40.0 109.585 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.23 -50.24 62.37 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.478 -0.764 . . . . 40.0 109.186 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.607 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 19.2 t80 -52.78 -49.54 65.37 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 121.72 0.772 . . . . 40.0 109.81 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.647 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.6 mt -68.6 -45.8 71.01 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.596 -0.69 . . . . 40.0 109.855 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -64.05 -23.02 67.17 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 118.6 -1.24 . . . . 40.0 110.625 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.2 m -105.41 -41.76 5.42 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.66 -1.275 . . . . 40.0 111.66 -179.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.601 ' O ' ' N ' ' A' ' 19' ' ' LYS . 79.2 m-85 -103.46 -16.08 15.69 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.762 -1.211 . . . . 40.0 110.846 -177.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.647 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.45 -36.64 0.11 Allowed 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 121.546 0.688 . . . . 40.0 110.662 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.607 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -66.86 118.72 10.75 Favored 'General case' 0 C--N 1.297 -1.698 0 O-C-N 120.83 -1.168 . . . . 40.0 108.265 179.06 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.503 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -45.51 132.93 6.19 Favored Pre-proline 0 N--CA 1.499 2.02 0 O-C-N 121.366 -0.834 . . . . 40.0 108.923 -179.222 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.479 ' O ' ' N ' ' A' ' 23' ' ' ASN . 62.6 Cg_exo -35.31 134.14 0.2 Allowed 'Trans proline' 0 C--N 1.313 -1.338 0 C-N-CA 122.246 1.964 . . . . 40.0 112.557 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.75 73.34 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.695 0.759 . . . . 40.0 110.067 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.678 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 2.0 p-10 174.05 19.23 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.763 -0.585 . . . . 40.0 111.197 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.515 ' CE1' ' HB1' ' A' ' 74' ' ' ALA . 13.4 m-85 -118.04 162.04 18.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.489 0.662 . . . . 40.0 111.542 -178.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -150.64 152.43 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.275 -0.891 . . . . 40.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 53' ' ' GLY . 76.2 p -72.4 151.7 42.46 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.532 -0.73 . . . . 40.0 109.407 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.646 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -48.7 -53.66 17.94 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.121 -1.066 . . . . 40.0 108.121 177.517 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.5 t -46.19 -63.42 0.99 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.547 -0.721 . . . . 40.0 110.312 178.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -48.27 -58.4 4.61 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.202 -0.937 . . . . 40.0 108.962 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.72 -49.41 62.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.353 -0.842 . . . . 40.0 110.228 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.441 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 55.6 mt-30 -64.99 -48.97 72.07 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.44 -0.787 . . . . 40.0 110.255 -178.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.28 -31.85 72.9 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.576 -0.703 . . . . 40.0 110.985 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mt -67.68 -19.3 65.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.498 -0.751 . . . . 40.0 109.075 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.5 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.14 0.4 5.1 Favored Glycine 0 N--CA 1.495 2.618 0 C-N-CA 119.945 -1.121 . . . . 40.0 111.358 178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.2 t90 -62.61 114.08 3.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.595 -1.532 . . . . 40.0 108.603 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.3 t -122.11 140.92 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.548 0 CA-C-O 121.891 0.853 . . . . 40.0 110.377 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.51 -47.02 85.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.44 -0.787 . . . . 40.0 109.886 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 35.6 p -77.74 50.42 0.84 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.886 -1.134 . . . . 40.0 109.063 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -175.79 -48.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 CA-C-O 121.137 0.494 . . . . 40.0 109.767 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.5 72.76 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 108.912 -1.675 . . . . 40.0 108.912 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.5 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.3 p-10 -56.04 130.76 45.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.798 -0.825 . . . . 40.0 109.326 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.602 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.0 tp -170.1 -58.16 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.66 -0.867 . . . . 40.0 108.66 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.54 -25.48 52.09 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.388 -0.82 . . . . 40.0 109.673 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.435 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -75.63 -65.22 0.93 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.0 -0.741 . . . . 40.0 109.0 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.2 m -67.14 -29.83 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.428 -0.795 . . . . 40.0 109.753 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.56 ' O ' ' N ' ' A' ' 48' ' ' GLY . . . -140.46 77.71 23.19 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.746 -0.596 . . . . 40.0 110.227 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.83 50.02 0.04 OUTLIER 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 123.276 2.65 . . . . 40.0 113.829 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.18 43.83 0.04 OUTLIER Glycine 0 N--CA 1.497 2.733 0 C-N-CA 119.556 -1.307 . . . . 40.0 111.375 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.556 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 10.2 tttt -121.75 145.04 48.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.874 -1.368 . . . . 40.0 109.436 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.5 m -119.26 133.74 55.59 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 120.797 -1.189 . . . . 40.0 110.455 -179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.8 mm -65.49 153.48 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.19 -0.944 . . . . 40.0 110.216 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.502 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.37 145.63 4.17 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.525 -1.43 . . . . 40.0 109.525 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.427 ' O ' HG22 ' A' ' 26' ' ' THR . . . 125.42 15.4 3.03 Favored Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.877 -1.154 . . . . 40.0 111.181 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.533 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -74.81 -166.86 0.5 Allowed 'General case' 0 C--O 1.194 -1.863 0 O-C-N 120.576 -1.544 . . . . 40.0 110.332 -179.077 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.5 mm -134.54 139.57 47.52 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.706 0 CA-C-O 121.6 0.714 . . . . 40.0 109.581 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -151.62 146.99 26.22 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.894 -0.78 . . . . 40.0 108.894 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.683 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -94.16 -18.06 22.12 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.364 -0.835 . . . . 40.0 109.672 -179.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.496 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.6 t30 68.71 30.24 4.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.359 -0.838 . . . . 40.0 111.917 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.683 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 0.9 OUTLIER -57.92 -29.98 65.55 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.904 -1.122 . . . . 40.0 108.134 178.534 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.442 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 20.9 mp0 -64.35 -11.38 31.83 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.324 0.583 . . . . 40.0 109.462 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.2 44.5 98.04 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 110.339 -1.104 . . . . 40.0 110.339 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.599 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.48 -12.74 25.36 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.566 -0.961 . . . . 40.0 108.828 179.849 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.671 HD21 ' CD2' ' A' ' 106' ' ' PHE . 52.3 mt -136.8 162.17 57.49 Favored Pre-proline 0 N--CA 1.497 1.912 0 N-CA-C 108.318 -0.993 . . . . 40.0 108.318 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.492 ' O ' ' NE1' ' A' ' 71' ' ' TRP . 86.6 Cg_exo -43.75 142.36 3.47 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 122.103 1.869 . . . . 40.0 112.667 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.624 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.77 -165.94 11.35 Favored Glycine 0 N--CA 1.492 2.429 0 C-N-CA 120.018 -1.087 . . . . 40.0 110.915 -178.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.471 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.3 pttm 173.5 -157.79 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 107.775 -1.194 . . . . 40.0 107.775 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.481 ' O ' ' OG ' ' A' ' 67' ' ' SER . 51.6 p -73.54 86.23 1.57 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 106.983 -1.488 . . . . 40.0 106.983 177.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.471 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 78.91 99.59 0.23 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.295 -1.522 . . . . 40.0 109.295 -178.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.624 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 18.5 tpp180 -121.85 140.84 51.89 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.388 -1.066 . . . . 40.0 110.031 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.6 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 24.8 p -109.4 130.83 55.48 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 108.123 -1.066 . . . . 40.0 108.123 178.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.503 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 33.8 m95 -121.82 143.69 49.26 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.324 -0.86 . . . . 40.0 111.16 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.579 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 1.1 mpp_? -141.61 147.5 37.73 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.453 -0.779 . . . . 40.0 109.692 -178.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.646 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -119.24 169.82 9.64 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 119.551 -0.86 . . . . 40.0 112.058 179.897 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.515 ' HB1' ' CE1' ' A' ' 24' ' ' TYR . . . -157.34 145.27 19.05 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.521 -0.737 . . . . 40.0 110.272 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.642 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -69.36 151.93 45.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.667 -0.645 . . . . 40.0 110.292 -179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.507 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 14.5 mm -135.95 152.65 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.178 -0.951 . . . . 40.0 110.049 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.532 HD22 ' CG ' ' A' ' 86' ' ' ASP . 75.1 m-20 57.94 51.15 9.3 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 121.01 0.433 . . . . 40.0 111.507 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.602 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 57.1 t80 -116.85 153.13 33.05 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.972 -1.08 . . . . 40.0 109.217 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.604 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.7 p -132.8 -77.55 0.49 Allowed 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 121.854 0.835 . . . . 40.0 109.608 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.604 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.58 102.28 2.71 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 109.442 -0.577 . . . . 40.0 109.442 -179.392 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 153.09 -104.27 0.25 Allowed Glycine 0 N--CA 1.499 2.874 0 N-CA-C 109.841 -1.304 . . . . 40.0 109.841 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.438 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 11.8 t80 -126.03 -179.41 4.69 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.681 -0.894 . . . . 40.0 109.91 178.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.46 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.3 mtm180 -80.96 -150.87 0.08 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 121.581 0.705 . . . . 40.0 110.049 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.461 HD21 ' HB2' ' A' ' 77' ' ' ASN . 27.3 p30 -164.3 -136.62 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.182 -1.044 . . . . 40.0 108.182 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.467 ' OG ' ' O ' ' A' ' 100' ' ' THR . 50.6 p -114.04 -9.12 13.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.808 -1.183 . . . . 40.0 109.192 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.665 ' OD1' HG22 ' A' ' 100' ' ' THR . 18.3 m-20 -73.69 109.36 7.14 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 116.287 -0.415 . . . . 40.0 110.394 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.83 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -136.12 137.25 40.81 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.369 -0.832 . . . . 40.0 110.258 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.544 ' O ' HD22 ' A' ' 89' ' ' LEU . 15.2 tt -108.39 145.88 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 CA-C-O 122.61 1.195 . . . . 40.0 110.592 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.0 mm? -123.1 127.23 48.44 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.841 -0.8 . . . . 40.0 108.841 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.579 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 2.0 p90 -132.05 140.72 48.98 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.746 -0.835 . . . . 40.0 108.746 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.503 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 77.6 p -107.23 178.46 4.54 Favored 'General case' 0 N--CA 1.51 2.56 0 CA-C-O 122.511 1.148 . . . . 40.0 112.662 -176.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.6 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -49.77 -54.97 15.84 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.569 1.176 . . . . 40.0 108.353 177.164 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.624 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.1 OUTLIER -67.75 6.34 0.68 Allowed 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 114.51 -1.223 . . . . 40.0 111.098 -178.848 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.452 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 67.4 m95 70.76 15.22 6.97 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.807 -0.558 . . . . 40.0 112.172 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.9 mt -70.37 127.14 31.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.169 -1.582 . . . . 40.0 106.819 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.909 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.3 mp -113.92 135.21 54.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.898 0 CA-C-O 123.004 1.383 . . . . 40.0 112.224 -177.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.628 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.0 m-85 -128.43 158.17 39.06 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.577 -1.268 . . . . 40.0 107.577 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.448 ' NZ ' ' HB2' ' A' ' 98' ' ' LYS . 5.9 ptmm? -126.69 145.97 50.38 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 118.714 -1.195 . . . . 40.0 112.566 -178.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.423 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.93 130.58 33.94 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.282 -1.377 . . . . 40.0 107.282 177.31 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.665 HG22 ' OD1' ' A' ' 86' ' ' ASP . 2.4 p -116.13 11.07 15.14 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.234 -0.654 . . . . 40.0 109.234 -177.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.589 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -117.29 34.71 4.99 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 119.723 -0.791 . . . . 40.0 109.498 178.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 61.8 68.33 0.7 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.431 -0.793 . . . . 40.0 111.02 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 60.1 43.85 13.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.429 -0.795 . . . . 40.0 110.279 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.589 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 28.7 mm-40 -116.47 -77.89 0.57 Allowed 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.833 -1.167 . . . . 40.0 108.66 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.514 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.4 p -94.25 120.21 34.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.737 -1.227 . . . . 40.0 110.642 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.671 ' CD2' HD21 ' A' ' 63' ' ' LEU . 10.0 m-85 -101.01 82.73 2.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.342 -0.848 . . . . 40.0 111.589 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 5.2 m -75.54 142.1 42.86 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.038 -1.038 . . . . 40.0 109.372 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.628 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 61.4 tttp -76.45 148.87 36.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.539 -0.726 . . . . 40.0 110.452 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.678 HD11 HG22 ' A' ' 96' ' ' ILE . 32.7 pt -131.4 -30.13 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 109.144 -0.687 . . . . 40.0 109.144 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.642 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.903 0 CA-C-O 118.394 -0.812 . . . . 40.0 109.088 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.684 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.5 t . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.176 -0.676 . . . . 40.0 109.176 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.563 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.9 mt -138.05 150.34 24.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.468 -0.77 . . . . 40.0 108.992 -179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -150.06 35.15 0.66 Allowed 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.159 -0.963 . . . . 40.0 109.397 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.4 p -119.27 141.58 48.83 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.924 -0.71 . . . . 40.0 110.331 -179.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.489 ' CE2' HG21 ' A' ' 76' ' ' ILE . 69.7 m-85 -43.54 -84.39 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.024 0.916 . . . . 40.0 112.904 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.6 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -46.97 -47.09 21.92 Favored 'General case' 0 C--N 1.289 -2.053 0 O-C-N 121.724 -0.61 . . . . 40.0 110.08 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.05 -48.53 62.66 Favored Glycine 0 N--CA 1.502 3.046 0 N-CA-C 110.497 -1.041 . . . . 40.0 110.497 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -44.11 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.4 . . . . 40.0 108.452 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.724 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -57.81 -58.04 10.11 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.607 -0.683 . . . . 40.0 110.12 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -51.11 61.35 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.693 -0.855 . . . . 40.0 108.693 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.616 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.9 t80 -50.35 -50.21 51.78 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.931 0.872 . . . . 40.0 109.671 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.614 HD21 ' HA ' ' A' ' 20' ' ' LEU . 24.4 mt -69.69 -45.17 68.9 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.543 -0.723 . . . . 40.0 110.481 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -63.53 -20.89 66.0 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 119.411 -0.915 . . . . 40.0 111.417 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.1 m -105.73 -45.02 4.51 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.692 -1.255 . . . . 40.0 111.463 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.573 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.6 m-85 -102.9 -15.07 16.29 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.351 -0.843 . . . . 40.0 110.913 -177.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.561 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-70 60.6 -30.5 0.06 Allowed 'General case' 0 N--CA 1.505 2.322 0 CA-C-O 121.447 0.641 . . . . 40.0 111.045 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.616 ' NZ ' ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -69.72 117.99 12.02 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.695 -1.253 . . . . 40.0 108.792 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.614 ' HA ' HD21 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -46.5 132.17 7.98 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.47 -0.769 . . . . 40.0 109.427 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.476 ' HD2' HD23 ' A' ' 20' ' ' LEU . 67.7 Cg_exo -36.59 133.66 0.35 Allowed 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.866 2.377 . . . . 40.0 112.5 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.566 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -64.67 75.62 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.011 0.91 . . . . 40.0 110.433 -179.174 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.684 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 174.0 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.733 -0.605 . . . . 40.0 110.406 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 50' ' ' SER . 18.1 m-85 -114.52 163.96 14.65 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.426 -0.796 . . . . 40.0 111.396 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.98 152.06 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.45 -0.781 . . . . 40.0 109.417 178.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 53' ' ' GLY . 61.2 p -72.39 150.75 43.13 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 108.909 -0.774 . . . . 40.0 108.909 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.632 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -49.98 -52.19 35.67 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.529 -0.915 . . . . 40.0 108.529 178.137 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -46.74 -61.58 1.78 Allowed 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.446 -0.784 . . . . 40.0 110.268 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.413 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 41.8 mt-10 -50.76 -56.64 11.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.153 -0.967 . . . . 40.0 109.234 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.97 -49.02 66.96 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.459 -0.776 . . . . 40.0 109.739 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.4 ' OE1' ' HB3' ' A' ' 27' ' ' LYS . 50.2 mt-30 -65.65 -49.22 69.43 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.751 -0.593 . . . . 40.0 110.291 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.68 -31.04 70.74 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.399 -0.813 . . . . 40.0 110.351 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.38 -18.85 65.3 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.134 -0.979 . . . . 40.0 109.267 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.562 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 133.04 -4.2 4.95 Favored Glycine 0 N--CA 1.497 2.719 0 C-N-CA 119.871 -1.157 . . . . 40.0 111.087 178.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -62.02 116.04 4.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.544 -1.562 . . . . 40.0 108.746 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 31.0 t -124.12 142.6 40.33 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 121.87 0.843 . . . . 40.0 110.506 -178.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.7 -48.06 83.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.353 -0.842 . . . . 40.0 110.561 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.8 p -77.68 48.17 0.66 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.825 -1.172 . . . . 40.0 109.318 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.8 tttp -173.58 -50.3 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.572 -0.705 . . . . 40.0 109.328 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.18 24.59 76.5 Favored Glycine 0 N--CA 1.497 2.709 0 N-CA-C 108.974 -1.651 . . . . 40.0 108.974 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.562 HD21 ' C ' ' A' ' 34' ' ' GLY . 4.8 p-10 -58.77 130.83 48.8 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.748 -0.854 . . . . 40.0 109.42 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.526 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.2 tp -170.77 -56.69 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.295 -1.002 . . . . 40.0 108.295 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.09 -23.27 32.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 40.0 109.906 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.79 -66.28 0.88 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.899 -0.778 . . . . 40.0 108.899 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 24.5 m -67.32 -26.98 37.36 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 109.079 -0.712 . . . . 40.0 109.079 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.661 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -142.5 77.97 16.77 Favored Pre-proline 0 N--CA 1.488 1.443 0 O-C-N 121.411 -0.806 . . . . 40.0 109.982 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.95 50.01 0.04 OUTLIER 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.972 2.448 . . . . 40.0 113.966 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.44 42.22 0.05 OUTLIER Glycine 0 N--CA 1.5 2.942 0 C-N-CA 119.766 -1.207 . . . . 40.0 111.338 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.661 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 13.4 tttt -119.83 147.69 44.36 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.906 -1.349 . . . . 40.0 110.035 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.458 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 13.1 m -117.6 134.1 55.24 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.155 -0.965 . . . . 40.0 109.994 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.482 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.3 mm -67.47 154.89 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.921 -1.112 . . . . 40.0 110.589 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.444 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.63 150.62 5.29 Favored Glycine 0 N--CA 1.49 2.298 0 C-N-CA 119.491 -1.338 . . . . 40.0 110.049 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.434 ' O ' HG22 ' A' ' 26' ' ' THR . . . 122.34 17.04 3.7 Favored Glycine 0 N--CA 1.494 2.561 0 O-C-N 121.213 -1.169 . . . . 40.0 110.739 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.549 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -75.64 -167.65 0.72 Allowed 'General case' 0 C--O 1.198 -1.628 0 O-C-N 120.989 -1.301 . . . . 40.0 110.426 -179.345 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.8 mm -134.46 141.56 43.13 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.542 0 CA-C-O 121.506 0.669 . . . . 40.0 110.239 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -153.46 145.91 24.06 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.173 -0.954 . . . . 40.0 110.033 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.68 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -92.24 -17.54 24.67 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.444 -0.785 . . . . 40.0 110.14 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.493 HD21 ' H ' ' A' ' 63' ' ' LEU . 66.5 t30 67.21 32.9 5.79 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 121.06 -1.025 . . . . 40.0 111.419 179.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.68 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 0.8 OUTLIER -60.84 -29.32 69.43 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.981 -1.074 . . . . 40.0 108.439 178.529 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.437 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 23.8 mp0 -64.63 -13.91 55.72 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 109.526 -0.546 . . . . 40.0 109.526 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.25 42.69 94.05 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 109.683 -1.367 . . . . 40.0 109.683 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.619 ' O ' ' NZ ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.57 -10.27 30.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.647 -0.914 . . . . 40.0 109.197 -179.592 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.554 HD21 ' CD2' ' A' ' 106' ' ' PHE . 30.7 mt -138.94 164.05 42.12 Favored Pre-proline 0 N--CA 1.492 1.659 0 N-CA-C 108.535 -0.913 . . . . 40.0 108.535 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.602 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 87.0 Cg_exo -45.16 139.91 8.16 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.025 1.817 . . . . 40.0 111.659 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.643 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -131.04 -166.29 11.69 Favored Glycine 0 N--CA 1.497 2.703 0 N-CA-C 110.392 -1.083 . . . . 40.0 110.392 -178.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.555 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.4 pttm 173.33 -158.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 107.859 -1.163 . . . . 40.0 107.859 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' A' ' 67' ' ' SER . 24.2 p -73.64 85.42 1.6 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.165 -1.42 . . . . 40.0 107.165 177.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.555 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 79.72 99.94 0.28 Allowed Glycine 0 N--CA 1.496 2.679 0 N-CA-C 108.863 -1.695 . . . . 40.0 108.863 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.643 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 16.9 tpp180 -123.45 140.89 52.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.535 -0.979 . . . . 40.0 110.508 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.612 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 29.5 p -108.83 130.25 55.4 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.632 -0.877 . . . . 40.0 108.632 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.602 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 30.7 m95 -121.48 146.85 46.49 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.343 -0.848 . . . . 40.0 110.381 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.649 ' HB2' ' CE1' ' A' ' 90' ' ' TYR . 0.9 OUTLIER -145.89 146.88 31.26 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.538 -0.726 . . . . 40.0 109.624 -179.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.632 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -116.3 170.72 8.32 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.177 -1.009 . . . . 40.0 112.352 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.445 ' O ' HG22 ' A' ' 88' ' ' ILE . . . -157.36 145.41 19.13 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.487 -0.758 . . . . 40.0 109.981 178.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.669 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.1 OUTLIER -70.44 153.25 43.16 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.551 -0.718 . . . . 40.0 110.408 -179.206 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.489 HG21 ' CE2' ' A' ' 7' ' ' PHE . 17.8 mm -137.61 153.37 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.11 -0.994 . . . . 40.0 110.088 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.489 HD22 ' CG ' ' A' ' 86' ' ' ASP . 73.8 m-20 55.07 58.49 4.69 Favored 'General case' 0 N--CA 1.5 2.033 0 CA-C-O 121.186 0.517 . . . . 40.0 111.267 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.526 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 56.1 t80 -121.83 155.2 35.87 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.217 -0.927 . . . . 40.0 108.739 178.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.576 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.8 p -132.32 -79.91 0.5 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-O 121.672 0.749 . . . . 40.0 109.84 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.576 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.27 101.67 2.86 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.88 -0.785 . . . . 40.0 108.88 -179.284 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.14 -109.09 0.4 Allowed Glycine 0 N--CA 1.5 2.952 0 C-N-CA 119.753 -1.213 . . . . 40.0 110.108 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.445 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 12.5 t80 -119.42 -177.97 3.49 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.358 -1.084 . . . . 40.0 110.06 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.445 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 4.2 mtm180 -84.47 -150.33 0.12 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.463 -0.773 . . . . 40.0 110.561 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.406 HD21 ' HB2' ' A' ' 77' ' ' ASN . 38.7 p30 -164.98 -135.93 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.743 -0.836 . . . . 40.0 108.743 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 100' ' ' THR . 45.6 p -114.21 -10.25 12.77 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.835 -1.166 . . . . 40.0 109.417 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.606 ' OD1' HG22 ' A' ' 100' ' ' THR . 15.5 m-20 -73.04 106.43 4.91 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 120.95 0.405 . . . . 40.0 110.131 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.858 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -134.05 139.27 45.88 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 119.585 -0.846 . . . . 40.0 110.172 179.768 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.639 ' O ' HD22 ' A' ' 89' ' ' LEU . 18.1 tt -110.12 148.78 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-O 122.064 0.935 . . . . 40.0 110.56 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.639 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.0 mm? -125.21 128.5 48.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.582 -0.699 . . . . 40.0 109.393 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.649 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 3.4 p90 -131.07 141.71 50.21 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 109.043 -0.725 . . . . 40.0 109.043 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.549 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 60.0 p -107.28 -179.11 3.83 Favored 'General case' 0 N--CA 1.504 2.252 0 CA-C-O 122.162 0.982 . . . . 40.0 112.209 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.612 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -54.55 -53.6 52.33 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.324 1.059 . . . . 40.0 108.794 177.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.58 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -65.9 2.2 1.14 Allowed 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 114.643 -1.162 . . . . 40.0 109.975 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 78.5 m95 73.56 16.85 3.88 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 122.017 -0.427 . . . . 40.0 111.652 179.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.477 HD23 ' HA ' ' A' ' 95' ' ' LEU . 24.4 mt -70.52 126.56 29.97 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 106.79 -1.559 . . . . 40.0 106.79 177.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.821 HG22 HD11 ' A' ' 109' ' ' ILE . 2.7 mp -114.26 134.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 CA-C-O 122.706 1.241 . . . . 40.0 112.013 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.524 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 10.3 m-85 -127.68 158.88 36.4 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.95 -1.13 . . . . 40.0 107.95 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.435 ' HB3' HD13 ' A' ' 109' ' ' ILE . 5.4 ptmm? -127.13 145.79 50.62 Favored 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 118.634 -1.226 . . . . 40.0 112.291 -178.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.454 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.97 129.81 32.69 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 106.897 -1.52 . . . . 40.0 106.897 177.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.606 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.4 p -115.98 9.93 15.0 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 109.585 -0.524 . . . . 40.0 109.585 -177.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.594 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.2 34.21 5.0 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.821 -0.751 . . . . 40.0 109.818 178.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 62.46 67.47 0.72 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.16 -0.963 . . . . 40.0 111.077 178.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 61.15 43.21 11.34 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -0.825 . . . . 40.0 110.451 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.594 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 29.5 mm-40 -115.88 -77.92 0.57 Allowed 'General case' 0 N--CA 1.511 2.617 0 O-C-N 120.614 -1.304 . . . . 40.0 109.267 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.503 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 21.2 p -93.74 120.82 34.51 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.068 -1.02 . . . . 40.0 110.207 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.556 ' CD1' ' NZ ' ' A' ' 62' ' ' LYS . 6.1 m-85 -102.73 83.77 2.31 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.378 0.609 . . . . 40.0 110.685 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 m -78.28 144.88 35.75 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.213 -0.995 . . . . 40.0 108.903 177.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.543 ' NZ ' ' O ' ' A' ' 110' ' ' ARG . 57.8 tttp -76.67 146.99 37.75 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 121.214 0.53 . . . . 40.0 110.322 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.821 HD11 HG22 ' A' ' 96' ' ' ILE . 15.6 pt -130.22 -28.2 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 109.148 -0.686 . . . . 40.0 109.148 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.603 ' HG2' HH11 ' A' ' 110' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.502 2.135 0 N-CA-C 109.128 -0.693 . . . . 40.0 109.128 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.68 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.8 t . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 109.249 -0.649 . . . . 40.0 109.249 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.587 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 10.6 mt -139.24 147.7 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 O-C-N 121.453 -0.78 . . . . 40.0 109.415 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.8 p-10 -149.55 34.4 0.7 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.276 -0.89 . . . . 40.0 109.712 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.3 p -119.51 144.75 46.85 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.913 -0.715 . . . . 40.0 110.115 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.518 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 62.5 m-85 -45.6 -86.83 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.49 -0.757 . . . . 40.0 112.752 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.633 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.8 OUTLIER -46.18 -48.05 17.61 Favored 'General case' 0 C--N 1.289 -2.061 0 O-C-N 121.672 -0.643 . . . . 40.0 109.761 -178.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.14 -53.35 23.62 Favored Glycine 0 N--CA 1.502 3.071 0 N-CA-C 110.149 -1.18 . . . . 40.0 110.149 178.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.8 t -63.83 -44.65 98.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 O-C-N 120.867 -1.372 . . . . 40.0 109.733 -179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 1.02 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -56.76 -57.06 14.09 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.257 -0.902 . . . . 40.0 109.934 179.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.99 -47.05 65.07 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.516 -0.55 . . . . 40.0 109.516 178.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.438 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 14.7 t80 -54.63 -50.26 68.54 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.901 0.858 . . . . 40.0 109.057 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.686 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 72.2 mt -70.72 -44.7 66.31 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.727 -0.608 . . . . 40.0 110.618 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.565 ' HG3' HD11 ' A' ' 96' ' ' ILE . 4.9 mt-30 -61.73 -26.86 68.32 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 119.122 -1.031 . . . . 40.0 110.722 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.9 m -102.28 -44.22 5.47 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 120.872 -1.143 . . . . 40.0 111.926 -178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.591 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.5 m-85 -102.85 -16.2 15.98 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.906 -1.121 . . . . 40.0 110.425 -177.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.686 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 3.4 m-70 62.1 -27.58 0.06 Allowed 'General case' 0 N--CA 1.502 2.169 0 CA-C-O 121.36 0.6 . . . . 40.0 110.895 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -71.28 122.41 20.21 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 120.82 -1.175 . . . . 40.0 108.756 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.682 ' HA ' HD21 ' A' ' 14' ' ' LEU . 2.0 mt -47.29 132.36 9.76 Favored Pre-proline 0 N--CA 1.497 1.915 0 O-C-N 121.428 -0.795 . . . . 40.0 109.144 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.52 ' HD2' HD23 ' A' ' 20' ' ' LEU . 71.5 Cg_exo -40.0 131.71 2.07 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 122.199 1.932 . . . . 40.0 112.626 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.625 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -63.47 78.59 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.876 0.845 . . . . 40.0 110.335 -179.591 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.68 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 170.47 15.17 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.915 -0.491 . . . . 40.0 110.503 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.435 ' HA ' ' O ' ' A' ' 50' ' ' SER . 17.5 m-85 -114.18 167.13 10.95 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.497 -0.752 . . . . 40.0 111.233 -179.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.55 152.1 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.415 -0.803 . . . . 40.0 109.049 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.448 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 77.8 p -72.17 151.67 42.8 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 108.405 -0.961 . . . . 40.0 108.405 178.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.649 ' HZ2' ' CG ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -50.83 -51.9 46.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.759 -1.213 . . . . 40.0 108.38 177.883 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.7 t -46.32 -62.91 1.14 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.841 -0.537 . . . . 40.0 110.252 178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.479 ' O ' HD12 ' A' ' 33' ' ' LEU . 45.2 mt-10 -48.74 -58.02 5.42 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.019 -0.734 . . . . 40.0 109.019 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.18 -49.33 64.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.591 -0.693 . . . . 40.0 109.575 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -64.86 -48.21 75.11 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.369 -0.832 . . . . 40.0 111.034 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.59 -31.8 72.1 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 40.0 110.746 -179.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 29' ' ' GLU . 0.5 OUTLIER -66.92 -20.51 65.92 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.77 -0.826 . . . . 40.0 108.77 179.749 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.562 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 132.61 -3.66 5.05 Favored Glycine 0 N--CA 1.493 2.465 0 C-N-CA 120.127 -1.035 . . . . 40.0 111.031 178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -60.94 114.32 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.549 -1.56 . . . . 40.0 108.318 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.8 142.85 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.376 -0.828 . . . . 40.0 110.48 -179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.46 -48.97 79.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.495 -0.753 . . . . 40.0 110.648 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 p -78.09 46.88 0.62 Allowed 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.112 -0.992 . . . . 40.0 109.147 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 tttp -169.92 -50.37 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 108.824 -0.806 . . . . 40.0 108.824 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.92 20.23 75.96 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.1 -1.6 . . . . 40.0 109.1 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.562 HD21 ' C ' ' A' ' 34' ' ' GLY . 6.7 p-10 -55.19 127.23 28.26 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.68 -0.894 . . . . 40.0 109.544 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.576 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.4 tp -166.83 -55.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 108.533 -0.914 . . . . 40.0 108.533 179.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.66 -29.74 53.41 Favored 'General case' 0 C--N 1.288 -2.069 0 O-C-N 121.052 -1.03 . . . . 40.0 110.065 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -62.73 1.34 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.396 -0.815 . . . . 40.0 109.443 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 24.4 m -71.57 -23.18 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-N 116.23 -0.441 . . . . 40.0 109.988 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.648 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -148.11 76.2 10.44 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 120.981 -1.075 . . . . 40.0 108.937 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -58.73 53.27 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.504 0 C-N-CA 122.391 2.06 . . . . 40.0 113.274 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.551 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 145.69 38.05 0.06 OUTLIER Glycine 0 N--CA 1.5 2.951 0 C-N-CA 119.913 -1.137 . . . . 40.0 111.577 178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.648 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 19.9 tttt -119.72 148.34 43.51 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.795 -1.415 . . . . 40.0 110.092 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 24' ' ' TYR . 5.2 m -120.26 134.8 55.19 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.136 -0.978 . . . . 40.0 109.93 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.461 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 2.9 mm -67.05 155.35 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.154 -0.966 . . . . 40.0 110.815 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.527 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 149.43 148.08 4.67 Favored Glycine 0 N--CA 1.491 2.358 0 C-N-CA 119.615 -1.279 . . . . 40.0 110.257 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 123.53 15.99 3.53 Favored Glycine 0 N--CA 1.496 2.642 0 C-N-CA 119.865 -1.159 . . . . 40.0 110.997 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.649 ' CG ' ' HZ2' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -74.31 -168.87 0.71 Allowed 'General case' 0 C--O 1.192 -1.936 0 O-C-N 121.04 -1.27 . . . . 40.0 110.386 -179.453 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.2 mm -132.85 140.92 46.26 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.844 0 CA-C-O 121.728 0.775 . . . . 40.0 110.423 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -153.43 148.12 26.31 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.475 -0.765 . . . . 40.0 109.149 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.682 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -94.29 -19.96 20.22 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.465 -0.772 . . . . 40.0 110.211 -179.165 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.518 HD21 ' H ' ' A' ' 63' ' ' LEU . 65.8 t30 69.95 31.19 3.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.448 -0.782 . . . . 40.0 111.889 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.682 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.4 mtm-85 -59.02 -31.15 68.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.821 -1.174 . . . . 40.0 108.129 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.466 ' H ' ' CD ' ' A' ' 60' ' ' GLU . 22.0 mp0 -62.88 -8.92 7.95 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.228 -0.656 . . . . 40.0 109.228 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 58.55 44.05 95.7 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 110.367 -1.093 . . . . 40.0 110.367 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.664 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -95.61 -12.29 25.86 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.61 -0.935 . . . . 40.0 108.78 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.603 HD21 ' CD2' ' A' ' 106' ' ' PHE . 28.3 mt -136.2 162.69 55.06 Favored Pre-proline 0 N--CA 1.499 2.024 0 N-CA-C 108.135 -1.061 . . . . 40.0 108.135 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.443 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 93.5 Cg_exo -42.78 142.32 2.14 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 121.98 1.786 . . . . 40.0 112.622 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.609 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -132.62 -166.42 11.5 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.002 -1.239 . . . . 40.0 110.002 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.5 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 2.0 pttm 171.5 -158.48 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.239 0 N-CA-C 107.126 -1.435 . . . . 40.0 107.126 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 67' ' ' SER . 51.0 p -72.4 87.71 1.17 Allowed 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 107.012 -1.477 . . . . 40.0 107.012 177.013 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.5 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 75.42 103.97 0.11 Allowed Glycine 0 N--CA 1.498 2.772 0 N-CA-C 109.559 -1.416 . . . . 40.0 109.559 -178.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.618 HH11 ' CG ' ' A' ' 93' ' ' ASP . 16.9 tpp180 -124.02 140.85 52.57 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.529 -0.983 . . . . 40.0 110.347 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.64 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 24.1 p -105.99 130.04 54.0 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.279 -1.008 . . . . 40.0 108.279 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.559 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 31.3 m95 -124.27 140.38 53.02 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.726 -0.789 . . . . 40.0 110.585 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.592 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.7 OUTLIER -143.5 149.55 37.67 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.286 -0.883 . . . . 40.0 108.926 -179.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.636 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -116.76 175.34 5.62 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.293 -0.879 . . . . 40.0 112.65 -178.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.527 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -162.24 142.53 10.04 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.557 -0.715 . . . . 40.0 110.27 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.656 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -67.73 153.17 44.31 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.74 -0.6 . . . . 40.0 110.844 -179.225 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.518 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 13.8 mm -136.93 151.61 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.382 -0.823 . . . . 40.0 109.798 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' A' ' 86' ' ' ASP . 76.9 m-20 57.27 53.71 7.43 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.143 0.496 . . . . 40.0 111.98 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.576 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 60.3 t80 -118.1 155.14 30.91 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.159 -0.963 . . . . 40.0 109.123 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 42.0 p -133.28 -78.2 0.48 Allowed 'General case' 0 N--CA 1.501 2.113 0 CA-C-O 121.716 0.769 . . . . 40.0 109.876 178.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -151.74 102.94 2.89 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 109.078 -0.712 . . . . 40.0 109.078 -179.546 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 152.97 -105.95 0.29 Allowed Glycine 0 N--CA 1.499 2.856 0 N-CA-C 109.788 -1.325 . . . . 40.0 109.788 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.431 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 14.1 t80 -126.38 -175.83 3.49 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -1.031 . . . . 40.0 109.942 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.432 ' NH1' ' OD1' ' A' ' 75' ' ' ASP . 2.5 mtm180 -84.75 -153.44 0.16 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.417 -0.802 . . . . 40.0 110.38 -178.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -163.7 -135.13 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.759 -0.83 . . . . 40.0 108.759 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' A' ' 100' ' ' THR . 28.1 p -113.84 -10.55 12.96 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.975 -1.078 . . . . 40.0 109.791 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.625 ' OD1' HG22 ' A' ' 100' ' ' THR . 14.1 m-20 -73.91 108.21 6.59 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 120.858 0.361 . . . . 40.0 110.821 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.828 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.03 140.48 45.64 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.469 -0.892 . . . . 40.0 110.391 179.36 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.619 HD11 HG21 ' A' ' 96' ' ' ILE . 18.1 tt -111.33 148.33 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 CA-C-O 122.108 0.956 . . . . 40.0 109.917 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.525 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.6 mm? -124.82 128.74 49.18 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.478 -0.764 . . . . 40.0 109.082 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.25 141.58 50.02 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.273 -0.892 . . . . 40.0 109.67 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.559 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 67.7 p -106.52 179.57 4.23 Favored 'General case' 0 N--CA 1.505 2.314 0 CA-C-O 122.51 1.148 . . . . 40.0 112.666 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.64 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.82 -51.98 58.8 Favored 'General case' 0 N--CA 1.502 2.143 0 CA-C-O 122.381 1.086 . . . . 40.0 109.118 177.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.618 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.0 5.1 1.24 Allowed 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 114.673 -1.149 . . . . 40.0 110.2 -178.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.494 ' CZ2' ' HB3' ' A' ' 18' ' ' HIS . 61.6 m95 72.76 11.52 5.41 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.882 -0.511 . . . . 40.0 112.097 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' A' ' 95' ' ' LEU . 23.1 mt -67.73 125.14 25.29 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 119.947 -1.72 . . . . 40.0 107.835 178.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 1.02 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.2 mt -112.62 133.25 59.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 122.865 1.317 . . . . 40.0 112.724 -176.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.565 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 16.0 m-85 -125.21 157.68 35.89 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 107.77 -1.196 . . . . 40.0 107.77 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.429 ' NZ ' ' HB2' ' A' ' 98' ' ' LYS . 5.5 ptmm? -127.92 141.24 51.6 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 119.205 -0.998 . . . . 40.0 112.934 -177.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.83 131.33 40.9 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.484 -1.302 . . . . 40.0 107.484 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.625 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.9 p -116.44 10.35 14.6 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 109.397 -0.594 . . . . 40.0 109.397 -178.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.573 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.1 OUTLIER -115.3 33.16 5.6 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 119.585 -0.846 . . . . 40.0 109.854 179.293 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 63.98 66.68 0.64 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.262 -0.899 . . . . 40.0 111.071 178.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 60.88 43.25 12.03 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.386 -0.821 . . . . 40.0 110.108 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.573 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.4 mm-40 -116.26 -76.92 0.57 Allowed 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.712 -1.243 . . . . 40.0 109.217 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.554 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 23.9 p -94.81 121.96 36.94 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.664 -1.273 . . . . 40.0 110.433 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.603 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.7 m-85 -102.9 86.14 2.67 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.56 -0.713 . . . . 40.0 110.584 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.5 m -79.28 146.42 32.99 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.197 -1.001 . . . . 40.0 108.334 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.565 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 57.5 tttp -78.28 146.32 34.89 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 121.304 0.573 . . . . 40.0 110.371 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.788 HD11 ' CG2' ' A' ' 96' ' ' ILE . 29.1 pt -126.97 -31.66 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 N-CA-C 108.933 -0.766 . . . . 40.0 108.933 177.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.633 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.989 0 CA-C-O 118.586 -0.721 . . . . 40.0 109.269 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.658 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 2.7 t . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 109.488 -0.56 . . . . 40.0 109.488 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.538 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 6.3 mt -137.97 149.74 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.461 -0.774 . . . . 40.0 109.419 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 -149.22 36.07 0.74 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.046 -1.034 . . . . 40.0 109.745 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.2 p -119.9 140.51 50.75 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.451 -0.9 . . . . 40.0 110.518 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.581 ' CE2' HG21 ' A' ' 76' ' ' ILE . 74.3 m-85 -41.2 -80.66 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.179 0.514 . . . . 40.0 111.746 -179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.544 ' CG ' HH22 ' A' ' 110' ' ' ARG . 1.1 m-20 -50.65 -45.83 58.07 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.566 -0.709 . . . . 40.0 111.108 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -52.04 -52.0 37.69 Favored Glycine 0 N--CA 1.498 2.828 0 N-CA-C 109.977 -1.249 . . . . 40.0 109.977 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.47 -44.27 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.404 -1.056 . . . . 40.0 109.672 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.823 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.66 -55.04 40.17 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.681 0.753 . . . . 40.0 109.408 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -44.36 88.66 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.953 -0.758 . . . . 40.0 108.953 179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.513 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.9 t80 -56.91 -48.24 78.7 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 122.233 1.016 . . . . 40.0 108.52 178.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.537 HD21 ' HA ' ' A' ' 20' ' ' LEU . 39.8 mt -68.73 -45.7 70.82 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.774 -0.579 . . . . 40.0 110.3 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -65.17 -24.34 67.35 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 118.66 -1.216 . . . . 40.0 111.22 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.3 m -98.27 -43.79 6.82 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.845 -1.159 . . . . 40.0 111.571 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.581 ' C ' ' H ' ' A' ' 19' ' ' LYS . 74.5 m-85 -108.98 -11.98 14.92 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.188 -0.945 . . . . 40.0 111.223 -177.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.497 ' CG ' ' CZ2' ' A' ' 94' ' ' TRP . 2.3 m-70 61.27 -25.62 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 121.567 0.699 . . . . 40.0 111.041 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.588 ' NZ ' ' OD2' ' A' ' 22' ' ' ASP . 0.1 OUTLIER -72.9 121.55 20.19 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 120.313 -1.492 . . . . 40.0 108.988 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.537 ' HA ' HD21 ' A' ' 14' ' ' LEU . 4.0 mt -48.02 129.34 12.07 Favored Pre-proline 0 C--N 1.283 -2.309 0 O-C-N 121.463 -0.773 . . . . 40.0 109.281 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.426 ' O ' ' N ' ' A' ' 23' ' ' ASN . 73.9 Cg_exo -33.62 133.48 0.12 Allowed 'Trans proline' 0 C--N 1.313 -1.339 0 C-N-CA 122.624 2.216 . . . . 40.0 113.052 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.588 ' OD2' ' NZ ' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -64.0 74.98 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.653 0.739 . . . . 40.0 110.258 -179.354 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.658 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.9 p-10 171.72 18.21 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.719 -0.613 . . . . 40.0 110.322 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -115.28 165.15 13.27 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.601 -0.687 . . . . 40.0 110.735 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -155.93 149.87 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 108.744 -0.835 . . . . 40.0 108.744 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.406 ' OG1' ' OE1' ' A' ' 29' ' ' GLU . 69.8 p -69.47 153.68 43.16 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.422 -0.799 . . . . 40.0 110.02 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.66 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.29 -51.46 58.44 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.14 -1.43 . . . . 40.0 107.14 177.042 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.8 t -47.36 -62.23 1.53 Allowed 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.48 -0.763 . . . . 40.0 110.362 178.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' OE1' ' OG1' ' A' ' 26' ' ' THR . 38.9 mt-10 -49.28 -57.2 7.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.356 -0.84 . . . . 40.0 109.356 179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.04 -49.43 66.33 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.674 0.749 . . . . 40.0 109.79 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -63.58 -49.59 72.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.728 -0.607 . . . . 40.0 110.16 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.51 -30.02 68.75 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.23 -0.919 . . . . 40.0 110.519 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 mt -66.72 -19.73 65.82 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.107 -0.996 . . . . 40.0 109.077 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.523 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 131.74 -1.4 5.14 Favored Glycine 0 N--CA 1.499 2.835 0 C-N-CA 120.073 -1.061 . . . . 40.0 111.143 179.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -61.54 114.88 3.5 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.657 -1.496 . . . . 40.0 109.301 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.8 t -123.32 140.24 47.56 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 O-C-N 121.262 -0.899 . . . . 40.0 109.962 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.39 -49.36 78.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.214 -0.929 . . . . 40.0 110.171 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.7 p -76.64 47.55 0.5 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.218 -0.926 . . . . 40.0 109.425 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -170.89 -49.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.645 -0.659 . . . . 40.0 109.283 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.62 17.4 74.78 Favored Glycine 0 N--CA 1.495 2.571 0 N-CA-C 109.173 -1.571 . . . . 40.0 109.173 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.523 HD21 ' C ' ' A' ' 34' ' ' GLY . 7.4 p-10 -55.61 130.95 45.09 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.455 -1.026 . . . . 40.0 108.946 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.588 HD11 HD11 ' A' ' 51' ' ' ILE . 1.4 tp -169.85 -55.77 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.704 -1.221 . . . . 40.0 107.704 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -57.76 -27.38 63.0 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.324 -0.86 . . . . 40.0 110.241 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.02 -57.31 3.95 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.847 0.832 . . . . 40.0 109.455 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.2 m -72.54 -29.4 30.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.955 -1.128 . . . . 40.0 107.955 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.565 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -143.05 79.38 14.48 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 121.557 -0.714 . . . . 40.0 110.306 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -59.11 54.9 0.06 OUTLIER 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 122.081 1.854 . . . . 40.0 113.535 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 144.12 40.7 0.06 OUTLIER Glycine 0 N--CA 1.503 3.135 0 C-N-CA 119.758 -1.211 . . . . 40.0 111.408 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 15.2 tttt -121.54 138.99 54.07 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.947 -1.325 . . . . 40.0 109.872 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 12.6 m -111.99 132.43 54.79 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.032 -1.043 . . . . 40.0 109.283 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.588 HD11 HD11 ' A' ' 42' ' ' LEU . 4.3 mm -63.54 151.29 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.373 -0.829 . . . . 40.0 110.028 -179.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.405 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 152.98 144.49 3.92 Favored Glycine 0 N--CA 1.488 2.116 0 C-N-CA 118.789 -1.672 . . . . 40.0 110.651 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 126.79 15.33 2.64 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 119.841 -1.171 . . . . 40.0 111.225 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.565 ' OD1' ' NZ ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -72.79 -170.36 0.69 Allowed 'General case' 0 C--O 1.198 -1.63 0 O-C-N 120.841 -1.388 . . . . 40.0 110.205 -179.291 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 5.6 mm -134.11 138.96 49.27 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.712 0 CA-C-O 121.489 0.662 . . . . 40.0 110.203 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -151.03 148.83 28.83 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.581 -0.699 . . . . 40.0 109.903 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.693 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -93.68 -21.16 19.53 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.504 -0.748 . . . . 40.0 110.777 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.509 HD21 ' H ' ' A' ' 63' ' ' LEU . 66.3 t30 71.12 28.12 3.15 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 40.0 111.839 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.693 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.7 mtm-85 -56.64 -32.36 65.27 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 120.957 -1.089 . . . . 40.0 108.151 178.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.433 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 24.6 mp0 -63.46 -9.22 11.73 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.401 -0.592 . . . . 40.0 109.401 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 60.93 44.66 97.86 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.236 -1.146 . . . . 40.0 110.236 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.663 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -93.8 -12.85 28.16 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.649 -0.912 . . . . 40.0 108.552 179.679 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.638 HD21 ' CD2' ' A' ' 106' ' ' PHE . 36.5 mt -138.04 166.57 25.01 Favored Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 108.744 -0.836 . . . . 40.0 108.744 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.6 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 81.7 Cg_exo -46.36 136.57 15.11 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 121.862 1.708 . . . . 40.0 112.387 -179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.622 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -125.81 -168.56 12.7 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.436 -1.466 . . . . 40.0 109.436 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.592 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 4.0 pttm 175.35 -156.28 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 N-CA-C 106.867 -1.531 . . . . 40.0 106.867 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.428 ' O ' ' OG ' ' A' ' 67' ' ' SER . 41.2 p -75.85 87.15 2.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.32 -1.487 . . . . 40.0 107.155 177.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.592 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 76.89 105.83 0.15 Allowed Glycine 0 N--CA 1.497 2.756 0 N-CA-C 108.262 -1.935 . . . . 40.0 108.262 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.622 ' NH2' ' O ' ' A' ' 65' ' ' GLY . 15.1 tpp180 -128.08 142.72 51.13 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.388 -1.066 . . . . 40.0 110.419 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.606 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 26.4 p -108.75 130.07 55.37 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 108.89 -0.782 . . . . 40.0 108.89 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.6 ' CZ2' ' HD2' ' A' ' 64' ' ' PRO . 31.3 m95 -123.33 143.57 50.01 Favored 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 119.931 -0.708 . . . . 40.0 110.838 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.565 HH12 ' HA ' ' A' ' 92' ' ' SER . 0.6 OUTLIER -145.28 148.47 33.5 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.243 -0.91 . . . . 40.0 109.693 -179.363 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.66 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -115.39 169.74 8.93 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.227 -0.92 . . . . 40.0 111.856 -179.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.405 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -156.01 144.37 20.01 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.336 -0.616 . . . . 40.0 109.336 178.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.643 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -69.59 154.32 42.17 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.621 -0.674 . . . . 40.0 110.631 -178.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.581 HG21 ' CE2' ' A' ' 7' ' ' PHE . 16.9 mm -137.08 152.67 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.164 -0.96 . . . . 40.0 109.908 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.498 HD22 ' CG ' ' A' ' 86' ' ' ASP . 74.3 m-20 56.35 57.18 5.11 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 121.031 0.444 . . . . 40.0 111.492 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.466 ' CG ' ' N ' ' A' ' 79' ' ' THR . 65.1 t80 -120.85 153.66 36.83 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.257 -0.902 . . . . 40.0 109.317 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.585 ' OG1' ' N ' ' A' ' 80' ' ' SER . 30.2 p -132.55 -78.63 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.888 0.851 . . . . 40.0 109.602 179.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.585 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER -152.44 102.17 2.72 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 108.855 -0.794 . . . . 40.0 108.855 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 154.48 -104.92 0.26 Allowed Glycine 0 N--CA 1.498 2.819 0 C-N-CA 119.557 -1.306 . . . . 40.0 109.961 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.419 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 18.1 t80 -126.59 -176.15 3.6 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.638 -0.919 . . . . 40.0 109.453 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.419 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 2.6 mtm180 -84.19 -150.69 0.12 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.379 -0.826 . . . . 40.0 110.212 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.444 HD21 ' HB2' ' A' ' 86' ' ' ASP . 41.9 p-10 -164.77 -134.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.567 -0.901 . . . . 40.0 108.567 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 26.5 p -115.66 -9.78 11.92 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.048 -1.033 . . . . 40.0 109.681 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.638 ' OD1' HG22 ' A' ' 100' ' ' THR . 20.3 m-20 -75.17 108.76 8.13 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 120.798 0.332 . . . . 40.0 110.821 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.832 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -135.22 140.15 45.06 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 119.34 -0.944 . . . . 40.0 109.734 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.666 HD11 HG21 ' A' ' 96' ' ' ILE . 13.8 tt -109.75 148.48 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 CA-C-O 122.019 0.914 . . . . 40.0 110.137 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.583 HD22 ' O ' ' A' ' 88' ' ' ILE . 1.8 mm? -124.18 129.15 50.32 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.768 -0.827 . . . . 40.0 108.768 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.512 ' CE1' ' HB2' ' A' ' 72' ' ' ARG . 5.6 p90 -132.53 140.94 48.53 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 109.658 -0.497 . . . . 40.0 109.658 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.532 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 71.5 p -107.54 -178.86 3.75 Favored 'General case' 0 N--CA 1.506 2.366 0 CA-C-O 122.292 1.044 . . . . 40.0 112.504 -177.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.606 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -55.5 -50.17 70.65 Favored 'General case' 0 N--CA 1.503 2.177 0 CA-C-O 122.193 0.997 . . . . 40.0 109.216 177.493 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.565 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -68.07 1.07 2.99 Favored 'General case' 0 C--N 1.293 -1.868 0 CA-C-N 115.022 -0.99 . . . . 40.0 109.536 -179.375 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 77.2 m95 73.01 17.2 4.2 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 122.089 -0.382 . . . . 40.0 111.116 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 95' ' ' LEU . 23.4 mt -70.39 125.45 26.85 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.146 -1.428 . . . . 40.0 107.146 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.823 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.6 mp -113.11 133.88 57.55 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.883 0 CA-C-O 122.767 1.27 . . . . 40.0 112.357 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.576 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.1 m-85 -126.75 158.83 35.48 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 107.985 -1.117 . . . . 40.0 107.985 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.431 ' NZ ' ' CZ ' ' A' ' 7' ' ' PHE . 4.8 ptmm? -127.71 142.18 51.4 Favored 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 119.218 -0.993 . . . . 40.0 112.983 -177.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.4 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -132.26 130.84 41.43 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.567 -1.272 . . . . 40.0 107.567 176.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.638 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.1 p -115.88 8.51 14.76 Favored 'General case' 0 N--CA 1.504 2.273 0 N-CA-C 109.534 -0.543 . . . . 40.0 109.534 -178.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.581 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.74 31.62 6.4 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.845 -0.742 . . . . 40.0 110.016 179.858 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 65.22 67.27 0.52 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.104 -0.998 . . . . 40.0 111.04 178.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 61.04 43.0 11.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.409 -0.807 . . . . 40.0 110.398 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.581 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 26.6 mm-40 -116.65 -77.39 0.57 Allowed 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.57 -1.331 . . . . 40.0 109.603 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.519 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 20.4 p -94.61 122.41 37.18 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.98 -1.075 . . . . 40.0 110.096 -178.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.638 ' CD2' HD21 ' A' ' 63' ' ' LEU . 5.1 m-85 -103.91 84.87 2.32 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.558 -0.713 . . . . 40.0 110.385 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.5 m -78.24 143.74 36.83 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.918 -1.114 . . . . 40.0 108.519 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.576 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 58.2 tttp -75.03 143.39 43.55 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.666 -0.646 . . . . 40.0 110.621 -179.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.757 HD11 HG22 ' A' ' 96' ' ' ILE . 31.9 pt -124.29 -29.96 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.798 -0.815 . . . . 40.0 108.798 177.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.554 ' HG2' HH11 ' A' ' 110' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.042 0 CA-C-O 118.719 -0.658 . . . . 40.0 109.304 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.689 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 1.2 t . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 109.145 -0.687 . . . . 40.0 109.145 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.552 ' H ' ' CG ' ' A' ' 23' ' ' ASN . 8.0 mt -139.06 147.61 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.336 -0.853 . . . . 40.0 109.433 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -147.22 33.35 0.89 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.335 -0.853 . . . . 40.0 110.349 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.6 p -117.79 142.17 47.59 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.571 0.701 . . . . 40.0 110.699 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.576 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 66.2 m-85 -42.52 -85.64 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.576 0 CA-C-O 122.229 1.014 . . . . 40.0 113.392 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.661 ' CG ' HH22 ' A' ' 110' ' ' ARG . 0.7 OUTLIER -45.84 -48.27 15.83 Favored 'General case' 0 C--N 1.285 -2.21 0 O-C-N 121.527 -0.733 . . . . 40.0 109.896 -179.952 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.6 -53.82 23.66 Favored Glycine 0 N--CA 1.499 2.86 0 N-CA-C 110.353 -1.099 . . . . 40.0 110.353 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.9 t -63.99 -44.24 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.349 -1.089 . . . . 40.0 109.725 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 1.09 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -58.97 -54.2 49.79 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.915 -1.116 . . . . 40.0 109.961 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -45.43 74.68 Favored 'General case' 0 N--CA 1.491 1.606 0 CA-C-O 121.447 0.641 . . . . 40.0 109.505 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.597 ' OH ' ' NZ ' ' A' ' 19' ' ' LYS . 17.7 t80 -56.74 -49.77 74.23 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.063 -1.088 . . . . 40.0 108.063 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.703 ' O ' ' ND1' ' A' ' 18' ' ' HIS . 35.4 mt -68.29 -44.42 75.53 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.897 -0.721 . . . . 40.0 109.592 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.538 ' HG3' HD11 ' A' ' 96' ' ' ILE . 8.1 mt-30 -65.37 -24.1 67.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.715 -1.241 . . . . 40.0 111.154 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 m -99.9 -50.2 4.09 Favored 'General case' 0 N--CA 1.516 2.842 0 O-C-N 121.106 -0.997 . . . . 40.0 111.809 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.631 ' C ' ' H ' ' A' ' 19' ' ' LYS . 83.7 m-85 -98.95 -16.23 18.83 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 120.92 -1.112 . . . . 40.0 111.76 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.703 ' ND1' ' O ' ' A' ' 14' ' ' LEU . 2.1 m-70 61.12 -19.65 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 121.395 0.617 . . . . 40.0 111.206 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.631 ' H ' ' C ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER -74.1 118.39 17.0 Favored 'General case' 0 C--N 1.291 -1.961 0 O-C-N 121.295 -0.878 . . . . 40.0 109.822 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.575 ' HA ' HD21 ' A' ' 14' ' ' LEU . 4.8 mt -43.84 128.14 4.17 Favored Pre-proline 0 N--CA 1.498 1.936 0 N-CA-C 107.505 -1.294 . . . . 40.0 107.505 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.468 ' HD2' HD23 ' A' ' 20' ' ' LEU . 52.8 Cg_exo -36.46 134.0 0.33 Allowed 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.008 2.472 . . . . 40.0 112.575 -178.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.627 ' O ' ' N ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -63.76 78.21 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.6 -0.688 . . . . 40.0 110.254 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.689 ' OD1' ' N ' ' A' ' 3' ' ' VAL . 1.8 p-10 168.24 16.27 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.468 -0.77 . . . . 40.0 110.399 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.417 ' CD1' ' O ' ' A' ' 50' ' ' SER . 14.8 m-85 -115.13 166.05 12.25 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-O 122.021 0.915 . . . . 40.0 110.944 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 30' ' ' ALA . 0.7 OUTLIER -155.7 151.25 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.186 -0.947 . . . . 40.0 109.022 178.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 53' ' ' GLY . 80.5 p -70.58 154.43 41.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.34 -0.85 . . . . 40.0 110.241 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.62 ' NZ ' ' OE2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -52.59 -51.72 58.56 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 107.228 -1.397 . . . . 40.0 107.228 177.138 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.7 t -46.58 -62.94 1.15 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.615 -0.678 . . . . 40.0 110.064 178.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -47.62 -58.15 4.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.408 -0.807 . . . . 40.0 109.435 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.457 ' HB2' HD12 ' A' ' 25' ' ' ILE . . . -52.71 -50.3 63.63 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.493 -0.755 . . . . 40.0 109.526 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.16 -49.86 72.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.849 -0.532 . . . . 40.0 110.768 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.48 -29.62 68.29 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.23 -0.919 . . . . 40.0 110.467 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -17.02 64.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.767 -1.208 . . . . 40.0 109.079 178.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.523 ' C ' HD21 ' A' ' 41' ' ' ASN . . . 128.12 1.18 6.31 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 120.376 -0.916 . . . . 40.0 111.434 179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -64.25 115.56 5.15 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.469 -1.606 . . . . 40.0 109.178 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 51.8 t -122.97 143.29 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 O-C-N 121.355 -0.841 . . . . 40.0 110.401 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.84 -49.09 76.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.572 -0.705 . . . . 40.0 109.97 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.9 p -78.69 50.62 1.0 Allowed 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.698 -0.853 . . . . 40.0 108.698 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 tttp -172.83 -51.44 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.738 -0.838 . . . . 40.0 108.738 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.99 20.33 76.15 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 108.939 -1.665 . . . . 40.0 108.939 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.523 HD21 ' C ' ' A' ' 34' ' ' GLY . 6.2 p-10 -55.73 128.08 33.1 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.987 -0.746 . . . . 40.0 108.987 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.678 HD23 ' CZ ' ' A' ' 78' ' ' TYR . 5.1 tp -166.86 -56.65 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.917 0.865 . . . . 40.0 109.074 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -56.39 -28.57 59.65 Favored 'General case' 0 C--N 1.289 -2.039 0 O-C-N 121.14 -0.975 . . . . 40.0 110.384 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.5 -62.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.532 -0.73 . . . . 40.0 109.299 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.409 ' H ' HG22 ' A' ' 45' ' ' VAL . 14.7 m -69.41 -29.66 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 CA-C-O 121.543 0.687 . . . . 40.0 109.977 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.599 ' HB1' ' HB2' ' A' ' 49' ' ' LYS . . . -142.93 78.55 15.35 Favored Pre-proline 0 C--N 1.299 -1.589 0 O-C-N 121.193 -0.942 . . . . 40.0 109.116 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -56.14 51.33 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 122.349 2.033 . . . . 40.0 114.685 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 46' ' ' ALA . . . 141.91 45.25 0.06 OUTLIER Glycine 0 N--CA 1.502 3.087 0 C-N-CA 119.463 -1.351 . . . . 40.0 111.112 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.599 ' HB2' ' HB1' ' A' ' 46' ' ' ALA . 23.8 tttt -122.92 146.19 47.81 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.757 -1.437 . . . . 40.0 109.329 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.417 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 7.6 m -117.3 131.77 56.74 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.708 -1.245 . . . . 40.0 110.848 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.478 ' O ' ' HB2' ' A' ' 75' ' ' ASP . 8.0 mm -60.27 149.14 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 CA-C-O 121.63 0.728 . . . . 40.0 110.866 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.419 ' HA3' ' HA ' ' A' ' 74' ' ' ALA . . . 151.94 147.1 4.49 Favored Glycine 0 N--CA 1.489 2.206 0 C-N-CA 119.152 -1.499 . . . . 40.0 110.916 179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.443 ' O ' HG22 ' A' ' 26' ' ' THR . . . 123.32 17.95 3.17 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.682 -0.77 . . . . 40.0 111.603 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.606 ' OD2' ' NZ ' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -74.21 -169.56 0.81 Allowed 'General case' 0 C--O 1.195 -1.774 0 O-C-N 120.801 -1.411 . . . . 40.0 110.074 -179.331 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 3.6 mm -133.19 139.13 50.01 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.801 0 CA-C-O 121.761 0.791 . . . . 40.0 110.2 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -150.3 147.79 28.06 Favored 'General case' 0 C--N 1.293 -1.882 0 C-N-CA 119.926 -0.71 . . . . 40.0 109.96 178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.702 ' OG ' ' NH1' ' A' ' 59' ' ' ARG . 0.1 OUTLIER -95.06 -16.66 22.51 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.818 -0.551 . . . . 40.0 110.03 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.51 ' ND2' ' O ' ' A' ' 63' ' ' LEU . 67.1 t30 68.11 28.46 6.6 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.453 -0.779 . . . . 40.0 111.785 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.702 ' NH1' ' OG ' ' A' ' 57' ' ' SER . 1.3 mtm-85 -56.78 -31.82 65.03 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.919 -1.113 . . . . 40.0 108.475 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.45 ' N ' ' CD ' ' A' ' 60' ' ' GLU . 21.1 mp0 -61.85 -13.02 20.43 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 109.344 -0.613 . . . . 40.0 109.344 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.63 43.89 98.33 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.839 -1.304 . . . . 40.0 109.839 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.644 ' NZ ' ' O ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -94.47 -12.36 27.86 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.476 -0.935 . . . . 40.0 108.476 179.546 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.581 HD21 ' CD2' ' A' ' 106' ' ' PHE . 31.9 mt -136.26 163.75 47.81 Favored Pre-proline 0 N--CA 1.493 1.684 0 N-CA-C 109.014 -0.736 . . . . 40.0 109.014 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.569 ' HD2' ' CZ2' ' A' ' 71' ' ' TRP . 92.1 Cg_exo -43.26 137.61 5.06 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.987 1.791 . . . . 40.0 112.366 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.539 ' O ' ' NH2' ' A' ' 69' ' ' ARG . . . -130.19 -169.5 12.51 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.065 -1.214 . . . . 40.0 110.065 -178.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.469 ' NZ ' ' O ' ' A' ' 68' ' ' GLY . 1.9 ptmm? 173.9 -158.81 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.138 -1.43 . . . . 40.0 107.138 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 67' ' ' SER . 24.4 p -73.33 88.51 1.55 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.034 -1.469 . . . . 40.0 107.034 177.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.469 ' O ' ' NZ ' ' A' ' 66' ' ' LYS . . . 74.79 103.98 0.09 OUTLIER Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.016 -1.634 . . . . 40.0 109.016 -177.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.607 HH11 ' CG ' ' A' ' 93' ' ' ASP . 17.0 tpp180 -125.41 143.06 51.16 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.942 -0.74 . . . . 40.0 109.467 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.639 ' OG1' ' CB ' ' A' ' 92' ' ' SER . 35.2 p -109.78 133.24 53.37 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.832 -1.173 . . . . 40.0 107.832 178.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.608 ' CZ2' ' HB3' ' A' ' 91' ' ' SER . 32.7 m95 -127.17 141.37 51.76 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.815 0.817 . . . . 40.0 110.474 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.629 HH12 ' HA ' ' A' ' 92' ' ' SER . 1.0 OUTLIER -144.89 146.67 32.13 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.54 -0.725 . . . . 40.0 109.378 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.62 ' OE2' ' NZ ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -113.93 172.97 6.66 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.154 -0.966 . . . . 40.0 112.354 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.419 ' HA ' ' HA3' ' A' ' 52' ' ' GLY . . . -159.22 143.7 15.42 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.766 -0.584 . . . . 40.0 109.734 179.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.617 ' CG ' HH21 ' A' ' 87' ' ' ARG . 0.2 OUTLIER -66.69 156.37 35.45 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.471 -0.768 . . . . 40.0 110.617 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.576 HG21 ' CZ ' ' A' ' 7' ' ' PHE . 13.8 mm -139.69 152.13 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.343 -0.848 . . . . 40.0 109.463 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.505 HD22 ' CG ' ' A' ' 86' ' ' ASP . 70.7 m-20 56.29 54.93 7.15 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.117 -0.492 . . . . 40.0 111.616 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.678 ' CZ ' HD23 ' A' ' 42' ' ' LEU . 52.7 t80 -116.72 155.49 28.78 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.997 -1.065 . . . . 40.0 108.968 177.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.577 ' OG1' ' N ' ' A' ' 80' ' ' SER . 32.9 p -132.84 -78.08 0.49 Allowed 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.82 0.819 . . . . 40.0 109.904 178.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.577 ' N ' ' OG1' ' A' ' 79' ' ' THR . 0.0 OUTLIER -152.47 102.73 2.76 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.155 -1.054 . . . . 40.0 108.155 -179.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 151.87 -108.16 0.36 Allowed Glycine 0 N--CA 1.501 3.022 0 N-CA-C 109.762 -1.335 . . . . 40.0 109.762 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.487 ' CD2' ' N ' ' A' ' 83' ' ' ARG . 20.1 t80 -124.67 -178.06 4.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.304 -1.115 . . . . 40.0 109.357 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.487 ' N ' ' CD2' ' A' ' 82' ' ' PHE . 1.3 mtm180 -83.44 -151.49 0.11 Allowed 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 121.795 0.807 . . . . 40.0 110.806 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.413 HD21 ' HB2' ' A' ' 77' ' ' ASN . 40.5 p30 -164.6 -133.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.782 -0.822 . . . . 40.0 108.782 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.482 ' OG ' ' O ' ' A' ' 100' ' ' THR . 24.5 p -116.08 -9.88 11.63 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.033 -1.042 . . . . 40.0 110.249 -179.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.655 ' OD1' HG22 ' A' ' 100' ' ' THR . 17.9 m-20 -74.65 110.9 9.33 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 122.172 -0.33 . . . . 40.0 110.595 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.831 ' NH1' ' HG2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -137.15 140.14 41.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.237 -0.914 . . . . 40.0 109.83 179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.629 ' O ' HD22 ' A' ' 89' ' ' LEU . 11.1 tt -110.35 148.79 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 122.389 1.09 . . . . 40.0 110.205 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.629 HD22 ' O ' ' A' ' 88' ' ' ILE . 2.2 mm? -125.62 128.01 47.2 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.663 -0.648 . . . . 40.0 109.323 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.524 ' CZ ' ' HB2' ' A' ' 72' ' ' ARG . 18.4 p90 -131.46 142.61 50.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.479 -0.763 . . . . 40.0 109.249 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.608 ' HB3' ' CZ2' ' A' ' 71' ' ' TRP . 90.0 p -107.34 178.51 4.52 Favored 'General case' 0 N--CA 1.504 2.241 0 CA-C-O 122.128 0.966 . . . . 40.0 112.679 -177.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.639 ' CB ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -52.42 -51.86 56.91 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-O 122.176 0.988 . . . . 40.0 109.059 177.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.607 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -69.03 5.24 1.22 Allowed 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 114.87 -1.059 . . . . 40.0 109.742 -179.002 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.588 ' HZ3' HD22 ' A' ' 14' ' ' LEU . 77.1 m95 69.53 19.69 7.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 122.05 -0.406 . . . . 40.0 111.608 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 95' ' ' LEU . 21.7 mt -72.87 127.61 33.05 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.285 -1.746 . . . . 40.0 106.285 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 1.09 HD13 ' HB1' ' A' ' 11' ' ' ALA . 2.4 mp -112.97 135.99 50.67 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.103 0 CA-C-O 122.914 1.34 . . . . 40.0 111.751 -177.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.628 ' CE2' ' HB2' ' A' ' 108' ' ' LYS . 12.9 m-85 -127.72 158.08 38.59 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 107.75 -1.204 . . . . 40.0 107.75 178.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.427 ' HD2' ' CG2' ' A' ' 109' ' ' ILE . 6.0 ptmm? -127.08 142.64 51.47 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.056 -1.027 . . . . 40.0 112.124 -178.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.48 HG23 ' HB2' ' A' ' 87' ' ' ARG . 0.0 OUTLIER -133.86 129.89 37.08 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.973 -1.491 . . . . 40.0 106.973 178.151 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.655 HG22 ' OD1' ' A' ' 86' ' ' ASP . 1.4 p -117.07 9.07 13.51 Favored 'General case' 0 N--CA 1.507 2.405 0 N-CA-C 109.506 -0.553 . . . . 40.0 109.506 -177.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.569 ' CG ' ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -113.97 33.4 5.25 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 119.584 -0.846 . . . . 40.0 109.772 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 101' ' ' ASP . . . 64.58 66.27 0.6 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.042 -1.036 . . . . 40.0 110.826 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 60.7 42.74 13.25 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.479 -0.763 . . . . 40.0 110.408 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.569 ' HB2' ' CG ' ' A' ' 101' ' ' ASP . 30.2 mm-40 -115.53 -77.64 0.57 Allowed 'General case' 0 N--CA 1.509 2.49 0 O-C-N 120.701 -1.249 . . . . 40.0 109.551 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.536 ' H ' ' CG ' ' A' ' 101' ' ' ASP . 19.7 p -93.03 121.1 34.02 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.606 -1.309 . . . . 40.0 110.177 -178.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.581 ' CD2' HD21 ' A' ' 63' ' ' LEU . 6.7 m-85 -102.33 83.7 2.36 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.644 -0.66 . . . . 40.0 110.911 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.1 m -76.35 144.35 40.18 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 122.106 0.955 . . . . 40.0 109.344 177.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.628 ' HB2' ' CE2' ' A' ' 97' ' ' TYR . 57.8 tttp -76.8 146.13 38.04 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 121.496 -0.753 . . . . 40.0 110.031 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.778 HD11 HG22 ' A' ' 96' ' ' ILE . 31.8 pt -127.61 -31.54 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 120.049 -0.66 . . . . 40.0 109.305 178.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.661 HH22 ' CG ' ' A' ' 8' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.501 2.121 0 N-CA-C 108.817 -0.809 . . . . 40.0 108.817 179.409 . . . . . . . . 2 2 . 1 stop_ save_