data_1brz_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 1brz _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.855 0.36 . . . . 0.0 110.692 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.67 122.48 13.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.752 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.93 125.48 45.94 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.436 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -67.07 127.86 29.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.32 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.535 ' O ' ' C ' ' A' ' 9' ' ' GLU . 2.9 t80 -61.25 73.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 7' ' ' VAL . 15.0 mp0 16.36 -125.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.67 0.606 . . . . 0.0 111.139 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 57.8 t-20 -57.21 -122.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 6.5 t80 97.64 95.67 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.609 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.24 115.47 1.75 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 121.786 1.658 . . . . 0.0 111.486 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 15' ' ' LYS . 68.0 t -50.69 -50.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.884 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 13' ' ' VAL . 69.6 p 19.12 -79.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.502 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 13' ' ' VAL . 21.3 tptp -65.44 -87.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.155 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.468 ' C ' ' O ' ' A' ' 15' ' ' LYS . 2.2 m 28.1 81.3 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 121.021 0.438 . . . . 0.0 111.625 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -142.26 -23.73 0.67 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.689 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.425 ' O ' ' O ' ' A' ' 19' ' ' ALA . 1.4 mt -165.17 -176.41 4.08 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.366 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -54.73 -157.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.118 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 21' ' ' GLN . 30.9 t30 76.38 -87.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.104 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.448 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -30.29 -90.37 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.729 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.6 m -55.68 -45.42 77.79 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -51.83 -71.74 0.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.428 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -49.91 -59.52 3.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.359 -179.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.9 m-20 -49.17 -54.75 14.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.541 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.0 m -54.74 -41.98 71.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -62.14 10.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.012 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.541 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.0 tt -165.49 -45.52 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.615 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 9.9 m-20 -67.16 -15.26 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.082 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -141.37 30.07 1.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.0 0.428 . . . . 0.0 110.808 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.453 ' C ' ' O ' ' A' ' 30' ' ' LYS . 4.5 m80 32.42 39.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.242 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 30' ' ' LYS . . . -87.69 -176.64 5.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.827 0.346 . . . . 0.0 111.037 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.96 -38.28 11.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.328 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -163.61 -157.08 0.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.401 179.595 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.519 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 163.07 169.21 26.17 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.143 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -178.05 170.2 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 55.4 m -86.7 127.39 34.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.767 0.318 . . . . 0.0 110.484 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -142.12 165.98 25.95 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.373 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -145.1 -178.1 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.856 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -121.79 -178.29 3.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.072 -179.906 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.32 42.97 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.399 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.539 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER -138.44 -25.29 0.93 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.932 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.539 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 2.2 tpt180 89.63 61.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.27 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 43' ' ' ARG . 4.9 m-20 -142.87 105.73 4.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.583 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.8 mt -86.57 136.2 33.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.543 0.687 . . . . 0.0 112.566 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.429 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 0.0 OUTLIER -145.67 153.87 41.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.22 179.4 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.535 ' SG ' ' CZ ' ' A' ' 11' ' ' TYR . 1.8 m -75.89 101.37 5.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.368 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.429 ' CD1' ' O ' ' A' ' 46' ' ' GLN . 2.1 mp -89.27 121.7 39.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.796 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.3 m -95.64 117.3 30.21 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.52 133.86 34.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.0 0.429 . . . . 0.0 111.542 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -103.63 -25.71 13.07 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.18 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 120.952 0.406 . . . . 0.0 111.159 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.531 0.234 0 CA-C-O 120.517 0.198 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -95.81 139.46 32.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.998 0.427 . . . . 0.0 111.275 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -140.39 101.83 4.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.818 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -61.8 130.39 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.814 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.477 ' O ' ' C ' ' A' ' 9' ' ' GLU . 1.1 t80 -72.66 67.33 0.77 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.477 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.0 mt-10 32.11 -149.7 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.302 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.61 ' CG ' ' H ' ' A' ' 11' ' ' TYR . 9.3 p30 -50.9 -67.33 0.26 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.401 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.61 ' H ' ' CG ' ' A' ' 10' ' ' ASN . 23.4 t80 99.4 128.72 0.02 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 C-N-CA 123.306 0.643 . . . . 0.0 110.585 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.557 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 72.6 Cg_exo -44.92 -69.16 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 121.353 1.369 . . . . 0.0 111.759 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.557 ' CG2' ' O ' ' A' ' 12' ' ' PRO . 66.2 t 110.44 18.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.801 1.313 . . . . 0.0 110.148 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.29 -21.52 65.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.639 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.94 141.04 0.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.923 0.392 . . . . 0.0 111.098 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -176.65 58.67 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.467 0.651 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.1 mm-40 -106.58 -22.72 12.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.704 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 mp -163.38 170.47 17.46 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.466 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 113.02 1.51 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.668 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -178.77 -95.9 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.172 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -46.11 -53.63 9.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.888 0.375 . . . . 0.0 110.319 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.1 t -60.55 -55.91 27.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.741 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -52.95 -65.98 0.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.468 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.531 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.29 -47.28 36.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.616 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.5 m-20 -53.55 -62.21 1.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.76 0.314 . . . . 0.0 110.531 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.521 ' C ' ' H ' ' A' ' 28' ' ' LEU . 99.3 m -54.4 -41.02 68.8 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.135 0.493 . . . . 0.0 109.968 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 5.24 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.917 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.521 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.4 tp -163.22 -47.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.375 -0.53 . . . . 0.0 112.256 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.616 ' N ' ' O ' ' A' ' 25' ' ' ASP . 72.9 m-20 -66.01 -10.95 44.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.241 0.543 . . . . 0.0 109.655 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 31' ' ' HIS . 4.2 tptt -143.33 9.79 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.067 179.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.43 ' C ' ' O ' ' A' ' 30' ' ' LYS . 3.3 p80 35.2 43.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.83 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.43 -166.21 1.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.835 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -33.95 11.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.626 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -174.06 -154.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.701 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.46 ' C ' ' OE1' ' A' ' 36' ' ' GLU . . . 152.73 179.65 28.45 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.532 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.46 ' OE1' ' C ' ' A' ' 35' ' ' GLY . 6.7 pm0 -177.53 175.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.671 -0.265 . . . . 0.0 110.307 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.09 148.94 22.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 0.0 111.4 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -146.61 146.02 30.28 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.434 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -76.87 151.44 35.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.103 0.478 . . . . 0.0 111.867 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -101.33 -179.89 4.16 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.759 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -64.7 -7.84 12.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.077 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.32 -80.4 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.08 32.68 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.75 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -128.87 144.53 51.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.82 0.343 . . . . 0.0 111.044 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.74 148.06 22.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.126 0.489 . . . . 0.0 111.162 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -141.78 147.51 37.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.061 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.413 ' SG ' ' CZ ' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -70.9 143.21 51.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 112.127 -179.214 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.0 mp -136.1 115.23 16.12 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.128 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.3 m -91.85 124.71 36.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.493 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -92.98 127.69 38.58 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.878 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -104.52 -3.33 24.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.135 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.466 0.334 0 CA-C-O 120.973 0.416 . . . . 0.0 111.06 179.9 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 111.331 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.23 136.49 33.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.428 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -149.9 123.53 9.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.986 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.64 145.1 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.351 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.562 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.2 t80 -92.29 74.5 5.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.818 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.562 ' O ' ' O ' ' A' ' 8' ' ' TYR . 25.8 mt-10 21.12 110.15 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.789 0.681 . . . . 0.0 112.72 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.503 ' C ' ' O ' ' A' ' 9' ' ' GLU . 3.9 t30 15.67 56.94 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.204 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.646 ' CD2' ' SG ' ' A' ' 47' ' ' CYS . 87.4 t80 -54.13 110.15 1.94 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.023 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.563 ' C ' ' H ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.05 117.2 1.77 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.833 1.689 . . . . 0.0 112.148 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.2 41.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.065 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.563 ' H ' ' C ' ' A' ' 12' ' ' PRO . 25.2 p -63.68 -32.3 73.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.862 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -172.56 141.52 1.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.294 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -173.09 0.07 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -87.49 46.73 1.41 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.8 mt -167.48 -95.85 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.262 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . 170.81 -165.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.827 0.346 . . . . 0.0 110.146 -178.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.584 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.7 t30 60.6 -74.55 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.515 ' N ' ' O ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -35.62 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 109.969 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.71 -45.44 92.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.449 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -76.2 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.088 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.584 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -42.3 -41.01 2.64 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.634 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.55 ' O ' ' N ' ' A' ' 29' ' ' ASP . 1.2 m-20 -52.88 -61.51 2.25 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.509 ' C ' ' H ' ' A' ' 28' ' ' LEU . 73.4 m -51.79 -47.33 64.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.501 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -61.18 12.22 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.674 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.8 tt -166.6 -37.88 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -66.62 -14.57 62.59 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.692 -179.378 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -143.2 3.55 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.2 m170 63.51 43.35 5.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.723 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.48 -178.55 5.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.011 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -92.82 -35.09 13.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.321 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.7 p -172.37 -159.59 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.928 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.17 175.59 23.96 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.83 -1.176 . . . . 0.0 113.524 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -178.59 165.97 1.73 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.502 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.7 OUTLIER -88.16 146.62 25.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.011 0.434 . . . . 0.0 111.514 -179.159 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -144.84 160.03 41.94 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.312 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 40' ' ' ASP . 7.6 m-85 -94.38 86.62 4.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.717 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -42.34 167.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.776 0.322 . . . . 0.0 110.342 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.01 -0.32 0.68 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.93 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HZ3' HD21 ' A' ' 44' ' ' ASN . 7.2 mtmp? -110.46 17.63 20.6 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? 60.62 61.45 1.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.156 0.503 . . . . 0.0 110.595 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.483 ' O ' ' OD1' ' A' ' 40' ' ' ASP . 87.4 m-20 -147.12 129.74 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.681 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 39' ' ' TYR . 4.7 mt -85.43 100.73 12.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.423 ' OE1' ' OD2' ' A' ' 40' ' ' ASP . 20.3 mt-30 -113.53 145.96 40.39 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.467 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.1 m -82.5 101.49 10.74 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.982 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 mp -88.42 111.77 22.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 82.7 m -93.85 125.3 38.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.266 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 51' ' ' TYR . 65.3 t0 -95.19 140.74 29.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.959 0.409 . . . . 0.0 110.91 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.508 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 55.8 m-85 -128.91 66.8 1.42 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.323 -178.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.4 ' C ' ' HE ' ' A' ' 33' ' ' ARG . 72.7 m . . . . . 0 C--N 1.328 -0.352 0 CA-C-O 121.048 0.451 . . . . 0.0 110.875 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.428 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.7 m . . . . . 0 CA--C 1.533 0.289 0 CA-C-O 120.77 0.319 . . . . 0.0 111.234 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.95 136.48 24.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 111.068 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.4 ' CB ' ' HZ1' ' A' ' 6' ' ' LYS . 7.4 mtmp? -151.83 133.19 14.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.142 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.72 152.56 9.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.367 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.446 ' C ' ' CD1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER -94.47 98.08 10.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.552 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -66.28 116.03 6.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.581 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -178.45 -98.58 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.136 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.431 ' OH ' ' OD2' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -53.8 149.79 15.81 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.583 -179.62 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.476 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 72.3 Cg_endo -75.16 10.91 1.62 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.464 2.109 . . . . 0.0 111.721 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.511 ' O ' ' CG1' ' A' ' 13' ' ' VAL . 97.8 t 102.06 2.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 124.72 1.262 . . . . 0.0 110.586 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.554 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 24.8 p -60.73 -75.08 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.554 ' N ' ' OG ' ' A' ' 14' ' ' SER . 29.6 mttm -66.96 102.58 1.0 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.225 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -172.37 28.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.416 -179.423 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -115.12 37.8 3.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.255 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 20' ' ' ASN . 0.5 OUTLIER -169.37 119.16 0.67 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.792 0.33 . . . . 0.0 111.159 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.23 52.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.165 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -140.87 -82.37 0.23 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.725 0.298 . . . . 0.0 111.24 -179.434 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 4.3 tp-100 -38.19 -61.69 0.64 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.911 0.386 . . . . 0.0 110.826 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.81 -54.62 39.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.251 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.45 -64.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.792 0.329 . . . . 0.0 110.247 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.455 ' CD1' ' O ' ' A' ' 24' ' ' TYR . 0.4 OUTLIER -50.64 -39.76 51.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.89 179.238 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.1 m-20 -55.36 -58.5 7.47 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.508 ' C ' ' H ' ' A' ' 28' ' ' LEU . 61.7 m -52.39 -43.55 64.82 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -59.62 7.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.583 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.7 tp -166.35 -37.02 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.515 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.5 m-20 -66.16 -13.27 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.371 . . . . 0.0 110.739 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -142.34 0.4 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.1 m80 64.33 45.43 3.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.945 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.75 -178.46 5.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.255 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.64 -32.01 12.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.305 0.574 . . . . 0.0 110.065 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.2 p 178.07 146.12 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.536 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.94 -177.16 23.7 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.845 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -178.62 168.63 1.75 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 0.0 110.918 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.8 m -88.8 132.22 34.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.437 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -143.79 164.83 29.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.534 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -91.41 104.52 17.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.996 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.571 ' C ' ' H ' ' A' ' 42' ' ' LYS . 8.9 p-10 -92.34 -177.48 4.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.041 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -63.29 39.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.616 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.571 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 21.11 1.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.869 0.366 . . . . 0.0 110.612 179.665 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 40.54 39.83 0.8 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.159 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -144.49 159.8 42.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.569 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 9.6 mt -85.4 94.98 9.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.688 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -90.47 139.94 30.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.396 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -83.8 93.77 8.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.9 mt -83.47 118.04 30.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.931 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 39.7 m -97.61 112.98 24.63 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.392 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -95.15 132.33 40.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 110.666 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.31 -42.69 7.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.548 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 23.0 m . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.652 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.173 0 CA-C-O 120.575 0.226 . . . . 0.0 111.11 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.85 135.57 35.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.99 0.424 . . . . 0.0 111.235 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -147.89 130.52 15.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.104 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -64.44 127.68 25.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.502 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.607 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 28.8 t80 -74.56 2.55 9.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.253 0.549 . . . . 0.0 110.527 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.56 ' O ' ' C ' ' A' ' 10' ' ' ASN . 9.9 pt-20 32.54 -154.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.676 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.56 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 11.89 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.457 0.473 . . . . 0.0 111.676 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.452 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 4.6 t80 -176.81 133.23 0.38 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.099 -179.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.586 ' O ' ' N ' ' A' ' 14' ' ' SER . 61.0 Cg_endo -71.0 47.28 0.73 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.128 1.885 . . . . 0.0 112.135 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.515 ' C ' ' O ' ' A' ' 12' ' ' PRO . 2.8 t 12.02 54.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.713 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 12' ' ' PRO . 74.8 p -63.58 -125.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.7 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 32.4 mttm -67.45 161.28 25.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.64 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 1.3 m -173.42 93.89 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.386 0.613 . . . . 0.0 111.34 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.475 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER 156.46 -48.02 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.782 -1.099 . . . . 0.0 108.888 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.6 mt -75.59 125.47 29.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.732 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.86 92.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.367 . . . . 0.0 110.672 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.595 ' CG ' ' H ' ' A' ' 21' ' ' GLN . 19.4 t-20 -173.43 -121.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.595 ' H ' ' CG ' ' A' ' 20' ' ' ASN . 14.3 mm-40 -5.17 -79.45 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.918 0.761 . . . . 0.0 112.412 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -55.72 31.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.447 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 20' ' ' ASN . 4.4 t-20 -53.13 -61.62 2.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.346 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.74 -57.62 8.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -50.1 -53.67 25.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.218 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.698 ' C ' ' H ' ' A' ' 28' ' ' LEU . 84.0 m -57.69 -47.13 83.21 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.425 ' HZ2' ' CB ' ' A' ' 34' ' ' SER . 0.1 OUTLIER -61.24 11.0 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.119 178.454 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.698 ' H ' ' C ' ' A' ' 26' ' ' CYS . 9.1 tp -161.14 -137.5 0.04 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 52.25 -78.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.678 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -101.32 -4.6 26.74 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 177.631 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.461 ' CD2' ' C ' ' A' ' 30' ' ' LYS . 10.5 m-70 70.19 65.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.263 178.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.21 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.264 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.479 HH21 ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.08 -34.03 10.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.293 0.568 . . . . 0.0 109.654 179.472 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.479 ' CB ' HH21 ' A' ' 33' ' ' ARG . 96.5 p -176.51 -169.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.035 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -153.76 174.12 32.36 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.108 -1.044 . . . . 0.0 113.349 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.86 143.51 0.43 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 99.5 m -90.05 157.18 17.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.062 0.458 . . . . 0.0 111.985 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -147.24 142.28 27.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.851 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -86.29 173.19 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 111.618 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.593 ' C ' ' H ' ' A' ' 42' ' ' LYS . 29.1 p-10 -118.89 178.88 4.32 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.737 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.67 25.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.959 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.593 ' H ' ' C ' ' A' ' 40' ' ' ASP . 14.3 tppt? -145.26 -77.78 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.968 0.413 . . . . 0.0 109.932 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.588 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -179.12 12.57 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.29 179.762 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.433 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 0.6 OUTLIER -90.7 133.51 35.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.942 0.401 . . . . 0.0 110.673 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.4 mt -90.93 160.27 15.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -141.96 136.01 29.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.038 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.93 100.42 12.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.471 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.457 ' N ' ' CD1' ' A' ' 48' ' ' ILE . 1.2 mp -89.62 116.41 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.594 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -94.78 119.26 33.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.652 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -94.07 123.17 37.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.571 0.7 . . . . 0.0 111.876 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -97.31 -94.43 0.22 Allowed 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.563 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.007 178.942 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.08 126.96 11.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.883 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.57 137.24 16.94 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.486 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.64 146.65 11.82 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.155 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.492 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.5 t80 -73.36 -16.12 61.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.361 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.642 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 88.23 143.34 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.643 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.493 ' C ' ' O ' ' A' ' 9' ' ' GLU . 13.6 t-20 15.33 46.61 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.926 0.766 . . . . 0.0 112.508 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.642 ' N ' ' O ' ' A' ' 9' ' ' GLU . 39.0 t80 -59.05 122.6 64.17 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.892 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -41.43 86.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.944 1.763 . . . . 0.0 112.031 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.55 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -53.17 97.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.039 0.447 . . . . 0.0 111.392 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -177.59 -82.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.333 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -68.71 99.33 1.0 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.601 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -172.59 105.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.494 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 169.37 36.11 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -166.6 145.29 5.44 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.887 0.375 . . . . 0.0 111.103 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.63 55.32 0.01 OUTLIER 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.237 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.601 ' N ' ' O ' ' A' ' 18' ' ' LEU . 7.1 t-20 -148.75 -115.06 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.604 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.568 ' H ' ' CG ' ' A' ' 20' ' ' ASN . 1.2 mp0 3.41 -79.76 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 123.74 0.65 . . . . 0.0 112.241 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -56.11 26.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.928 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -53.12 -61.26 2.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.319 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.537 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.45 -54.52 26.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.363 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.429 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.0 m-20 -51.35 -66.42 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.315 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.576 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.6 m -47.23 -43.92 22.24 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.94 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -59.48 8.71 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.924 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.576 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.9 tp -164.28 -36.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.942 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.429 ' N ' ' O ' ' A' ' 25' ' ' ASP . 15.4 m-20 -70.23 -21.42 63.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.862 0.363 . . . . 0.0 110.875 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' CG ' ' OH ' ' A' ' 51' ' ' TYR . 3.8 tptp -136.11 5.69 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.061 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.53 31.91 20.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.795 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.33 -177.73 6.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.93 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -99.08 -23.88 15.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.637 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.406 ' CB ' HD22 ' A' ' 23' ' ' ASN . 1.7 p -175.06 -165.32 0.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.864 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.53 -175.7 46.57 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.55 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -175.96 146.44 0.7 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.928 0.394 . . . . 0.0 111.316 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.24 105.83 18.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -99.85 125.19 45.77 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.003 0.43 . . . . 0.0 112.082 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -73.98 174.36 8.7 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.103 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 3.0 p30 -173.52 156.15 2.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.748 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.478 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.2 pt-20 16.45 -74.53 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.872 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -99.09 45.43 1.0 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.382 -179.148 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.572 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 23.5 66.0 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.808 179.612 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.443 ' C ' ' CD2' ' A' ' 45' ' ' LEU . 0.6 OUTLIER -97.75 -3.76 38.42 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.443 ' CD2' ' C ' ' A' ' 44' ' ' ASN . 1.2 pt? 36.74 93.83 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.21 0.529 . . . . 0.0 112.018 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mp0 -94.12 138.11 32.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.803 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.449 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -77.0 98.11 4.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.809 -178.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.5 mt -86.51 114.56 26.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.708 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 65.6 m -91.31 117.73 29.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.467 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -95.26 127.83 41.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.0 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.454 ' OH ' ' CG ' ' A' ' 30' ' ' LYS . 39.4 m-85 -97.47 4.82 50.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.727 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.408 . . . . 0.0 110.435 179.465 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.14 0 CA-C-O 120.881 0.372 . . . . 0.0 110.767 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.8 141.04 27.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.976 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 134.68 24.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.958 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -61.48 131.67 26.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.681 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.6 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -67.14 -3.03 6.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.498 ' O ' ' O ' ' A' ' 10' ' ' ASN . 4.9 mt-10 90.46 -123.41 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.905 0.753 . . . . 0.0 110.398 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.569 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 10.5 m120 -53.47 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.269 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.569 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 24.1 t80 102.29 137.94 0.01 OUTLIER Pre-proline 0 N--CA 1.47 0.55 0 O-C-N 123.73 0.644 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.58 83.95 1.66 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.096 1.864 . . . . 0.0 112.226 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.0 t -52.61 106.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.002 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.6 p -173.51 -80.17 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.928 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -65.99 -17.79 64.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.911 0.386 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.497 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -65.15 84.07 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.46 179.832 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.2 mm-40 -132.85 -11.39 3.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.316 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.8 mt -165.48 167.08 17.87 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.935 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.541 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -57.28 137.1 56.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.58 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.554 ' CG ' ' N ' ' A' ' 21' ' ' GLN . 1.6 t-20 150.45 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.257 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.554 ' N ' ' CG ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -50.03 -55.18 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.217 179.847 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.0 t -59.45 -54.62 44.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.458 ' C ' HD21 ' A' ' 23' ' ' ASN . 0.4 OUTLIER -52.11 -67.84 0.22 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.762 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.558 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.11 -46.65 53.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.963 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.1 m-20 -49.2 -61.24 2.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.533 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.534 ' C ' ' H ' ' A' ' 28' ' ' LEU . 92.2 m -55.03 -42.73 72.98 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.587 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -60.17 7.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.323 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.2 tp -164.42 -20.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 25' ' ' ASP . 2.0 m-20 -68.27 -64.52 0.85 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.781 0.324 . . . . 0.0 110.648 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mttp -101.06 12.66 37.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.65 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.8 m170 68.3 39.35 2.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.194 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.72 -177.04 5.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.907 0.384 . . . . 0.0 111.323 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.67 -37.74 11.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.502 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.582 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.7 p -177.64 -140.33 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.627 0.251 . . . . 0.0 110.786 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.582 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 124.53 -159.31 19.16 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.727 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.77 171.8 2.18 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.35 131.83 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 111.567 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -149.42 -171.19 3.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.241 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.595 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 6.6 m-85 -90.65 141.61 28.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.944 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.599 ' C ' ' H ' ' A' ' 42' ' ' LYS . 1.3 p-10 -99.3 171.2 8.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.356 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -64.19 36.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.382 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.599 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.6 OUTLIER -143.01 8.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.057 0.456 . . . . 0.0 110.316 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' C ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 59.93 58.86 2.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.571 -179.726 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 2.3 m120 -143.82 -138.18 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.056 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.484 ' O ' ' OE1' ' A' ' 46' ' ' GLN . 27.0 tp -155.12 129.25 8.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.88 0.372 . . . . 0.0 111.414 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.484 ' OE1' ' O ' ' A' ' 45' ' ' LEU . 1.0 OUTLIER -145.76 175.81 10.12 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.214 0.531 . . . . 0.0 111.105 -179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.414 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -95.25 103.47 15.33 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.092 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.3 mm -83.2 113.1 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 111.011 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -95.91 125.42 40.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.433 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.57 ' OD1' ' N ' ' A' ' 51' ' ' TYR . 61.5 t0 -94.29 143.09 26.69 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.503 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.57 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 81.7 m-85 -129.32 31.33 4.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.302 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.5 m . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.891 0.376 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -138.76 127.37 23.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.194 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -144.87 110.02 5.15 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.101 0.477 . . . . 0.0 111.417 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.5 m -69.36 143.49 14.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.522 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.517 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.7 OUTLIER -89.86 71.76 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.002 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.94 71.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.321 -178.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.531 ' O ' ' C ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER 177.94 -79.16 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.536 179.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.548 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.3 t80 -0.42 114.4 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.448 0 O-C-N 123.915 0.759 . . . . 0.0 112.438 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.431 ' O ' ' N ' ' A' ' 14' ' ' SER . 86.8 Cg_exo -44.11 98.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.0 t -54.29 87.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.933 0.396 . . . . 0.0 111.131 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.453 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 1.7 p -176.2 139.44 0.36 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.59 ' C ' ' H ' ' A' ' 17' ' ' GLN . 0.5 OUTLIER 84.2 8.54 0.52 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -67.95 21.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.814 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.59 ' H ' ' C ' ' A' ' 15' ' ' LYS . 1.6 mp0 -94.93 18.27 12.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 mt -166.96 147.03 5.56 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.012 0.434 . . . . 0.0 111.18 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.444 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.52 -178.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.967 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.615 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.5 OUTLIER 80.22 -72.42 0.07 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.757 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.7 OUTLIER -54.91 77.07 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.359 179.578 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ASN . 66.8 m 125.98 -54.29 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.601 1.16 . . . . 0.0 109.04 -178.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -55.16 -54.91 37.24 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.453 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -56.18 -53.86 52.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.977 178.66 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -46.73 -51.84 15.28 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.731 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.652 ' C ' ' H ' ' A' ' 28' ' ' LEU . 55.6 m -59.31 -43.45 92.65 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -58.08 4.16 0.02 OUTLIER 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.583 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.652 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.7 tp -164.8 -124.99 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.075 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 36.88 -81.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.73 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.645 ' N ' ' O ' ' A' ' 28' ' ' LEU . 2.2 mptp? -92.78 14.92 15.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.936 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.582 ' N ' ' O ' ' A' ' 28' ' ' LEU . 22.3 m170 62.97 49.71 3.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.862 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.542 ' CB ' ' O ' ' A' ' 26' ' ' CYS . . . -90.37 -173.29 3.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.83 0.348 . . . . 0.0 110.586 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -114.3 -31.77 6.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.828 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.9 p -165.99 -168.11 1.2 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.41 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . 160.68 175.22 31.45 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.353 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -176.77 176.38 1.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 111.007 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.0 m -88.27 136.92 32.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.856 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -143.19 131.22 21.75 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.843 0.354 . . . . 0.0 111.664 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -72.42 166.82 21.82 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.476 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.405 ' OD1' ' N ' ' A' ' 44' ' ' ASN . 1.3 p30 -139.99 179.27 6.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.99 -14.78 51.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.49 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.95 5.98 49.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.988 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 18.6 ttp180 62.65 53.72 2.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.722 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.405 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 10.0 m-80 -143.95 135.55 26.04 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.626 ' CD2' ' H ' ' A' ' 45' ' ' LEU . 0.2 OUTLIER -92.1 104.85 17.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.09 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 137.86 32.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.561 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 21.1 m -82.53 104.51 12.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.105 0.478 . . . . 0.0 110.884 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.41 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 17.1 mt -87.03 124.4 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.779 -178.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -98.37 113.84 25.96 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.944 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -93.45 154.93 17.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.013 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.6 -33.4 2.54 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.15 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.33 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.293 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.1 m . . . . . 0 CA--C 1.528 0.099 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -93.68 133.22 37.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.554 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.16 127.34 13.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 111.074 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.58 146.04 13.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.9 OUTLIER -70.51 90.53 0.74 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.62 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -62.29 74.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.241 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.62 ' ND2' ' O ' ' A' ' 9' ' ' GLU . 20.2 p30 125.15 118.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.728 1.211 . . . . 0.0 109.968 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 42.1 t80 178.56 140.22 0.26 Allowed Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.318 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.7 73.66 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.145 1.897 . . . . 0.0 112.43 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.0 t -55.38 99.75 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.874 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.0 p -175.89 -66.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.914 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -65.57 -3.92 5.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.967 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.42 83.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.107 0.48 . . . . 0.0 110.631 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.425 ' H ' HD13 ' A' ' 18' ' ' LEU . 40.1 mt-30 -145.87 22.78 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.296 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.602 ' CD1' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -164.42 129.73 2.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.076 0.465 . . . . 0.0 110.447 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.27 74.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.905 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.607 ' O ' ' N ' ' A' ' 23' ' ' ASN . 12.5 t-20 -162.39 -113.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.526 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.556 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -3.18 -78.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.719 0.637 . . . . 0.0 112.098 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.6 t -58.89 -54.35 48.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 110.786 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' ASN . 60.3 t30 -52.17 -64.85 0.68 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.232 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.479 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.54 -41.9 61.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.257 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.497 ' O ' ' N ' ' A' ' 29' ' ' ASP . 1.5 m-20 -54.39 -71.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.13 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.505 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -51.97 -32.18 32.32 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.248 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -59.57 0.2 0.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.396 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.505 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.8 tt -164.93 -26.72 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.717 0.294 . . . . 0.0 111.667 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.497 ' N ' ' O ' ' A' ' 25' ' ' ASP . 1.3 m-20 -69.37 -52.59 25.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 110.822 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.88 11.72 34.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.492 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.8 m170 62.11 33.22 17.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.886 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.2 -179.79 6.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -29.59 13.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 110.398 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.5 p -179.13 -169.94 0.16 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.141 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 169.13 179.77 41.33 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.334 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -175.68 153.62 1.45 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -88.67 137.06 32.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.838 0.352 . . . . 0.0 111.212 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -147.56 152.45 37.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.45 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -57.08 -173.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.855 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 26.4 p-10 -170.75 85.07 0.1 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 40' ' ' ASP . 4.8 pt-20 30.56 27.8 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.821 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 1.5 mtpt -148.59 6.11 0.72 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.727 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 66.55 -2.82 0.97 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.128 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 42' ' ' LYS . 7.8 m-80 -95.42 140.34 30.43 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.513 ' N ' ' CD1' ' A' ' 45' ' ' LEU . 2.3 mp -78.97 155.42 28.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.666 0.745 . . . . 0.0 112.778 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.433 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -142.95 132.95 24.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.105 179.2 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.7 m -75.52 98.57 3.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.433 ' CD1' ' O ' ' A' ' 46' ' ' GLN . 1.8 mp -86.66 107.39 16.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.36 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.3 m -97.97 119.19 36.15 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.819 0.343 . . . . 0.0 111.278 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -93.86 129.91 40.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -95.59 -32.65 12.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.054 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.499 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.53 0.176 0 CA-C-O 120.738 0.304 . . . . 0.0 111.186 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.51 158.26 43.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.424 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.48 119.29 6.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.042 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.572 ' C ' ' H ' ' A' ' 9' ' ' GLU . 2.9 m -63.29 139.22 21.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.905 0.383 . . . . 0.0 110.985 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.544 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 28.5 t80 -51.06 -5.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.808 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.583 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 28.0 mt-10 91.15 6.79 0.07 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.368 0.667 . . . . 0.0 111.39 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.583 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 52.5 t-20 113.47 74.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.1 0.875 . . . . 0.0 111.669 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 22' ' ' CYS . 4.1 t80 -54.11 144.05 40.76 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.532 ' O ' ' C ' ' A' ' 13' ' ' VAL . 19.7 Cg_endo -60.13 40.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.194 1.929 . . . . 0.0 112.678 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 11' ' ' TYR . 76.9 t 8.15 81.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 123.325 0.65 . . . . 0.0 112.598 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.5 p -175.77 20.8 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -172.05 101.74 0.17 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.163 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.8 OUTLIER -170.95 1.77 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.55 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -78.16 50.95 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.064 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.459 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 2.2 mp -165.22 -114.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.773 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 165.67 46.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 0.0 110.703 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 21' ' ' GLN . 3.2 t-20 -137.9 -63.62 0.56 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.49 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.8 tp-100 -39.83 -72.23 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.866 0.365 . . . . 0.0 110.601 -179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 5.1 m -62.68 -45.18 93.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -50.34 -67.31 0.27 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.579 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.529 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.83 -50.82 55.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -43.39 -57.27 3.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.63 ' C ' ' H ' ' A' ' 28' ' ' LEU . 76.1 m -58.55 -45.33 89.15 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -57.05 0.48 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.508 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.794 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.1 tp -165.54 -131.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.501 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 35.3 -68.69 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 123.675 0.609 . . . . 0.0 112.481 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.794 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -87.47 -5.43 58.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.983 0.42 . . . . 0.0 110.098 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.547 ' N ' ' O ' ' A' ' 28' ' ' LEU . 1.6 m170 79.17 36.3 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.039 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.522 ' CB ' ' O ' ' A' ' 26' ' ' CYS . . . -89.89 -179.69 5.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.578 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 53.0 mtt-85 -99.55 -28.75 13.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.228 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.5 p -175.95 -159.67 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.519 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.92 -176.16 41.38 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.936 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -176.34 158.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.819 0.342 . . . . 0.0 110.495 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.6 m -88.88 147.91 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.215 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -139.3 132.24 29.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.747 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -89.78 139.21 30.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.91 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.599 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -93.48 76.42 4.44 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.096 0.474 . . . . 0.0 110.783 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' A' ' 40' ' ' ASP . 2.3 pt-20 19.02 44.94 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.631 -1.168 . . . . 0.0 112.114 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.9 mtpm? -142.3 -65.83 0.4 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.554 ' CG ' ' O ' ' A' ' 42' ' ' LYS . 2.3 mmm180 167.79 -21.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.915 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -87.98 172.35 9.63 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.544 ' N ' ' CD1' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -149.53 168.97 22.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.497 0.665 . . . . 0.0 112.527 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -135.92 141.57 44.54 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.346 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 90.3 m -92.6 103.43 15.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.108 -179.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 57.7 mt -84.54 120.17 34.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.614 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.1 m -92.76 116.1 28.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -90.76 120.77 32.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.244 0.545 . . . . 0.0 111.121 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.578 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 66.5 m-85 -97.81 13.62 29.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.654 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 73.0 m . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.913 -179.905 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.151 0 CA-C-O 120.679 0.276 . . . . 0.0 111.382 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.26 134.26 19.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.808 0.337 . . . . 0.0 110.674 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.97 131.8 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -64.55 141.57 18.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.419 ' HB3' ' H ' ' A' ' 9' ' ' GLU . 0.4 OUTLIER -44.52 -85.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.65 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.512 ' O ' ' N ' ' A' ' 11' ' ' TYR . 2.0 mt-10 -178.07 -155.3 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.702 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.56 ' O ' ' C ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -39.17 -25.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.562 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.684 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 2.3 t80 1.67 91.68 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.86 0.725 . . . . 0.0 111.685 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.519 ' O ' ' C ' ' A' ' 13' ' ' VAL . 60.6 Cg_endo -74.14 59.16 4.45 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 121.836 1.69 . . . . 0.0 112.269 -179.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.595 ' CG2' ' H ' ' A' ' 14' ' ' SER . 7.3 p 6.83 -119.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.452 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.595 ' H ' ' CG2' ' A' ' 13' ' ' VAL . 1.4 p 84.83 -2.78 0.93 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.039 0.447 . . . . 0.0 110.06 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.436 ' CG ' ' C ' ' A' ' 14' ' ' SER . 2.4 mttt -164.41 108.7 0.95 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.327 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -172.67 97.7 0.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.046 0.451 . . . . 0.0 111.142 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.483 ' CG ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mt-30 -172.71 23.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.304 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.82 146.33 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.525 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.26 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.133 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.58 ' O ' ' N ' ' A' ' 23' ' ' ASN . 4.1 t-20 -173.8 -132.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.061 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.573 ' H ' ' CG ' ' A' ' 20' ' ' ASN . 13.4 mm-40 8.32 -87.43 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.979 0.8 . . . . 0.0 112.379 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 39.6 m -53.46 -56.68 14.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.955 0.407 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.58 ' N ' ' O ' ' A' ' 20' ' ' ASN . 2.5 t30 -52.46 -64.79 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.488 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -51.91 -50.97 60.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.135 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.602 ' O ' ' N ' ' A' ' 29' ' ' ASP . 67.8 m-20 -51.39 -60.27 3.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.889 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.474 ' C ' ' H ' ' A' ' 28' ' ' LEU . 66.9 m -54.51 -41.38 69.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.037 0.446 . . . . 0.0 110.169 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.461 ' HZ3' ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -59.48 3.75 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.17 -179.608 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.474 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.9 tt -163.27 -36.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.285 -0.566 . . . . 0.0 112.324 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 25' ' ' ASP . 85.4 m-20 -68.07 -44.07 77.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.801 0.334 . . . . 0.0 110.662 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.6 10.73 26.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m80 42.37 48.21 4.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.059 0.457 . . . . 0.0 110.008 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.97 -177.69 6.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.655 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.597 ' NE ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -101.67 -30.11 11.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.046 0.45 . . . . 0.0 110.343 179.851 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.584 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.2 OUTLIER -172.99 155.19 3.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.278 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.484 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 165.04 175.17 35.51 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.547 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 38' ' ' PHE . 10.8 pt-20 -178.2 -162.64 0.06 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.781 0.324 . . . . 0.0 110.734 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -87.06 129.22 35.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.279 179.475 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 36' ' ' GLU . 34.7 m-85 -147.05 167.07 24.98 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.334 0.587 . . . . 0.0 111.857 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.526 ' O ' ' O ' ' A' ' 40' ' ' ASP . 65.0 m-85 -98.17 -117.59 0.14 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.801 178.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.526 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.1 OUTLIER 51.4 149.55 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.42 0.629 . . . . 0.0 112.014 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.471 ' CG ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 89.41 -56.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.474 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.473 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 1.9 ttmt -149.63 30.61 0.74 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 54.72 18.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.995 0.426 . . . . 0.0 110.311 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.473 ' OD1' ' O ' ' A' ' 42' ' ' LYS . 6.6 m-20 -95.75 125.5 40.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.697 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.436 ' CD1' ' CE1' ' A' ' 39' ' ' TYR . 6.6 tp -85.78 112.4 21.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.813 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -142.22 161.32 38.31 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 112.23 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.684 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 73.0 m -75.62 96.66 3.6 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.873 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.3 mt -90.27 117.17 33.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.358 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 59.7 m -93.48 110.53 22.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.038 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' SER . 0.9 OUTLIER -93.1 160.67 14.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.786 0.803 . . . . 0.0 112.265 -178.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 4' ' ' CYS . 87.4 m-85 -128.35 -28.41 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.209 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.749 179.7 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.532 0.262 0 CA-C-O 120.641 0.258 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.85 154.87 43.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.726 0.298 . . . . 0.0 110.765 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -151.12 121.14 7.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.293 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -63.06 116.35 2.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.564 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -55.52 76.45 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.129 -179.476 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 7' ' ' VAL . 50.5 mt-10 8.81 117.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.511 ' C ' ' O ' ' A' ' 9' ' ' GLU . 6.0 m-20 14.47 52.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.613 ' O ' ' N ' ' A' ' 13' ' ' VAL . 87.4 t80 -54.6 136.61 62.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -40.43 84.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 121.852 1.701 . . . . 0.0 111.768 179.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -56.61 106.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.53 -179.061 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 89.2 p -175.75 -86.55 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.06 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.605 ' CB ' ' HZ1' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -69.59 159.28 33.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.949 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.581 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.0 m -170.58 -79.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.678 0.275 . . . . 0.0 111.393 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' LEU . 2.4 mp0 63.08 13.22 6.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.151 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.473 ' C ' ' O ' ' A' ' 17' ' ' GLN . 4.4 mp 28.38 57.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.325 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 173.86 35.53 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.03 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.574 ' O ' ' N ' ' A' ' 23' ' ' ASN . 1.2 t-20 -174.5 -118.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.652 ' N ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -1.01 -83.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.997 0.811 . . . . 0.0 112.209 179.534 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 0.3 OUTLIER -58.57 -50.78 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.256 -179.755 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -51.55 -69.04 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.931 0.396 . . . . 0.0 110.51 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.47 -47.12 66.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.935 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' A' ' 29' ' ' ASP . 94.9 m-20 -56.9 -67.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.602 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.579 ' C ' ' H ' ' A' ' 28' ' ' LEU . 4.3 m -50.42 -40.52 50.46 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.227 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -58.91 5.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.665 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.579 ' H ' ' C ' ' A' ' 26' ' ' CYS . 3.2 tm? -163.46 -40.92 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.878 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 25' ' ' ASP . 32.4 m-20 -68.21 -53.07 27.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.746 0.307 . . . . 0.0 111.298 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -99.74 18.63 17.68 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.904 0.383 . . . . 0.0 111.097 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 41.46 35.65 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.886 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.44 -171.91 3.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.16 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -95.17 -48.0 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.825 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.476 ' O ' ' OD2' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -163.48 145.8 9.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.076 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.4 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -114.91 178.21 17.79 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.895 -0.669 . . . . 0.0 113.314 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.4 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 4.8 mt-10 -174.66 139.98 0.57 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -88.78 145.28 25.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 0.0 110.896 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -144.04 142.16 30.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.929 0.395 . . . . 0.0 110.718 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.478 ' O ' ' OD2' ' A' ' 40' ' ' ASP . 63.2 m-85 -72.21 -177.7 2.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.866 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.589 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.3 OUTLIER 163.35 -172.2 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.419 0.628 . . . . 0.0 111.195 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.8 OUTLIER 24.95 -82.23 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.143 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.604 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 26.2 mmtt -134.26 79.29 1.8 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.831 0.348 . . . . 0.0 111.645 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 46.65 28.38 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.121 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.604 ' OD1' ' N ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -94.44 122.83 37.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.622 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 12.1 mt -89.08 109.11 20.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.685 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -93.22 135.84 34.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.657 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.487 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.3 m -77.21 100.97 5.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -86.78 116.73 29.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.556 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 99.2 m -93.76 111.47 23.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.865 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.476 ' OD2' ' O ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -88.0 143.32 27.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.524 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -112.46 -3.9 14.34 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.86 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.9 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.741 0.305 . . . . 0.0 110.761 -179.921 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.536 0.405 0 CA-C-O 120.863 0.364 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.01 139.17 25.92 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.032 0.444 . . . . 0.0 111.55 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.694 ' HZ2' ' HH ' ' A' ' 51' ' ' TYR . 25.8 pttt -151.77 140.72 21.08 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.754 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.98 154.94 3.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 121.22 0.533 . . . . 0.0 111.818 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.714 ' CE2' ' CZ ' ' A' ' 11' ' ' TYR . 57.1 t80 -91.05 -16.77 27.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.602 -178.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.53 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 22.48 110.97 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.367 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 11' ' ' TYR . 1.4 t-20 170.27 -71.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 177.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.714 ' CZ ' ' CE2' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -46.72 173.54 0.04 OUTLIER Pre-proline 0 C--O 1.231 0.087 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.708 179.73 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.543 ' O ' ' CG1' ' A' ' 13' ' ' VAL . 16.7 Cg_exo -66.05 -14.84 46.28 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.358 1.372 . . . . 0.0 110.189 178.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.543 ' CG1' ' O ' ' A' ' 12' ' ' PRO . 1.9 p 103.94 -20.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.224 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.78 -33.67 75.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.682 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -69.19 147.26 51.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 110.57 179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -175.55 -75.74 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 49.56 29.91 3.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.2 0.524 . . . . 0.0 110.072 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.3 mt 44.69 -133.45 0.75 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.408 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.23 80.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.562 ' O ' ' N ' ' A' ' 22' ' ' CYS . 1.8 t-20 -176.83 -117.14 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.902 0.382 . . . . 0.0 111.69 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.591 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 1.8 tp60 -57.73 54.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 112.277 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.591 ' SG ' ' O ' ' A' ' 21' ' ' GLN . 1.7 m 177.8 -58.79 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.527 ' C ' HD21 ' A' ' 23' ' ' ASN . 0.2 OUTLIER -59.19 -52.0 67.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.387 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -48.9 78.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.879 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 29' ' ' ASP . 3.7 m-20 -52.8 -53.91 41.63 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.348 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.529 ' C ' ' H ' ' A' ' 28' ' ' LEU . 71.7 m -53.39 -46.62 69.75 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 13.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.511 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.529 ' H ' ' C ' ' A' ' 26' ' ' CYS . 52.7 tp -165.27 -36.37 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.415 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.515 ' N ' ' O ' ' A' ' 25' ' ' ASP . 65.1 m-20 -68.62 -44.43 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.623 0.249 . . . . 0.0 111.021 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.471 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 42.2 mmtt -107.79 -0.16 21.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.195 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.471 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER 75.78 35.7 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.13 177.39 7.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.213 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -107.43 -5.37 17.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.577 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.406 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER 174.39 -169.26 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.365 -179.815 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -173.65 -165.03 29.8 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.636 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.502 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 2.0 mt-10 -176.44 -164.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 110.366 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.4 m -144.17 132.35 21.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.628 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -146.62 169.86 18.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.071 0.462 . . . . 0.0 111.531 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.614 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.0 m-85 -100.84 120.15 39.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.639 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.681 ' O ' ' N ' ' A' ' 42' ' ' LYS . 5.3 p-10 -122.65 123.38 41.02 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 40' ' ' ASP . 15.2 tt0 21.74 35.17 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.855 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.681 ' N ' ' O ' ' A' ' 40' ' ' ASP . 19.4 mtmm -147.1 -6.24 0.5 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.687 0.279 . . . . 0.0 111.34 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 31.6 mmt-85 57.56 10.08 0.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.008 0.432 . . . . 0.0 110.049 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 10.2 m-20 -94.73 -130.91 0.15 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.303 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.3 mt -152.95 95.17 1.94 Allowed 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.453 ' NE2' ' CG ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -89.7 156.1 18.77 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 178.702 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 13.3 m -106.65 115.18 29.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.062 0.458 . . . . 0.0 111.292 -178.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 23.0 mt -88.93 132.29 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.727 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 92.1 m -100.38 112.47 24.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.005 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.415 ' H ' ' HA2' ' A' ' 35' ' ' GLY . 0.4 OUTLIER -94.24 140.51 29.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.203 0.525 . . . . 0.0 111.302 -179.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.694 ' HH ' ' HZ2' ' A' ' 6' ' ' LYS . 71.7 m-85 -113.46 -24.91 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.167 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.174 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.17 0 CA-C-O 120.715 0.293 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -118.11 134.14 55.27 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.858 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.599 ' HZ1' ' HH ' ' A' ' 51' ' ' TYR . 0.8 OUTLIER -149.22 125.49 10.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.998 0.428 . . . . 0.0 111.27 179.401 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.33 144.27 14.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.434 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.51 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.5 t80 -84.68 61.89 7.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.926 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.574 ' O ' ' N ' ' A' ' 11' ' ' TYR . 4.1 mm-40 32.94 -159.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.625 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -58.73 44.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.207 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.586 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 7.0 t80 -52.92 134.41 48.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.567 ' C ' ' H ' ' A' ' 14' ' ' SER . 84.6 Cg_exo -39.32 85.54 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.156 1.904 . . . . 0.0 112.475 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' TYR . 9.6 p -57.48 1.3 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.401 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.567 ' H ' ' C ' ' A' ' 12' ' ' PRO . 35.7 p -62.94 -95.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.286 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.401 ' H ' ' HG ' ' A' ' 14' ' ' SER . 0.4 OUTLIER -66.66 113.79 5.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.007 0.432 . . . . 0.0 111.447 -179.468 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -175.06 108.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.205 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -143.24 -23.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.674 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.13 -178.94 4.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 110.961 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.43 112.1 1.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.57 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.407 ' OD1' ' OE1' ' A' ' 21' ' ' GLN . 0.8 OUTLIER -175.55 -105.66 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.782 179.42 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.494 ' O ' ' OD2' ' A' ' 25' ' ' ASP . 9.6 mm100 -50.05 -55.89 12.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.851 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.7 t -55.7 -57.38 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.26 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -51.45 -64.88 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.874 0.368 . . . . 0.0 110.625 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.552 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.69 -47.03 64.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.326 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.555 ' O ' ' N ' ' A' ' 29' ' ' ASP . 20.1 m-20 -52.12 -64.71 0.73 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.538 ' C ' ' H ' ' A' ' 28' ' ' LEU . 89.9 m -51.32 -50.32 59.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -61.87 14.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.712 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.538 ' H ' ' C ' ' A' ' 26' ' ' CYS . 3.3 tm? -163.73 -41.01 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.265 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.555 ' N ' ' O ' ' A' ' 25' ' ' ASP . 3.5 m-20 -67.43 -47.61 69.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.418 ' HZ1' ' CB ' ' A' ' 30' ' ' LYS . 3.1 mtpm? -101.25 6.53 42.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.829 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.401 ' CD2' ' N ' ' A' ' 31' ' ' HIS . 0.1 OUTLIER 58.15 36.66 26.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.535 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.75 -174.77 5.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.038 0.447 . . . . 0.0 111.467 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.4 tpt85 -93.87 -25.96 17.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.7 p -176.35 -164.11 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.287 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 159.83 176.02 31.45 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.792 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -177.0 164.43 2.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 0.0 110.437 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 136.82 33.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.872 0.368 . . . . 0.0 110.519 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -146.73 162.16 39.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 23.0 m-85 -86.07 175.95 8.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.03 0.443 . . . . 0.0 111.462 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.627 ' C ' ' H ' ' A' ' 42' ' ' LYS . 17.9 p-10 -109.41 173.21 6.42 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.322 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.506 ' OE1' ' N ' ' A' ' 41' ' ' GLU . 53.0 mp0 -65.14 27.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.673 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.627 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 -74.15 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.571 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.467 ' O ' ' CG ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER 169.71 70.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.387 179.631 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 70.8 m-80 -141.61 -155.42 0.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.428 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.55 137.05 21.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.807 0.337 . . . . 0.0 110.608 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -146.97 139.69 25.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.586 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -82.65 100.2 10.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.318 179.517 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.2 mm -82.89 112.58 20.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.556 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.7 m -95.76 117.51 30.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.227 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.446 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 0.1 OUTLIER -95.01 143.65 26.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.929 0.395 . . . . 0.0 110.727 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.599 ' HH ' ' HZ1' ' A' ' 6' ' ' LYS . 7.8 m-85 -114.23 -26.67 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.611 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.2 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.743 0.306 . . . . 0.0 110.887 179.864 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.743 0.306 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.61 153.35 40.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.763 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -149.71 128.92 12.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.116 0.484 . . . . 0.0 111.638 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.6 m -64.34 146.3 13.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.615 179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.75 76.96 7.15 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.559 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.5 pt-20 -61.58 82.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.416 -178.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 1.3 t-20 153.73 -2.82 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.286 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.639 ' CE1' ' SG ' ' A' ' 47' ' ' CYS . 3.9 t80 -55.83 129.43 71.64 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.632 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.535 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.4 Cg_exo -59.77 45.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 121.91 1.74 . . . . 0.0 113.256 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.566 ' N ' ' O ' ' A' ' 11' ' ' TYR . 36.0 t 2.97 93.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 123.705 0.628 . . . . 0.0 112.665 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.714 ' HG ' ' H ' ' A' ' 15' ' ' LYS . 85.1 p -171.22 -97.41 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.154 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.714 ' H ' ' HG ' ' A' ' 14' ' ' SER . 18.0 tttp -63.93 117.11 6.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.95 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.425 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -172.0 -12.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.019 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -80.39 33.18 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.597 0.237 . . . . 0.0 110.79 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.425 ' H ' ' C ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -166.96 116.97 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.724 -179.672 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.77 99.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.654 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.488 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.6 OUTLIER -168.82 -86.78 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -45.55 -61.0 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.306 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.574 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.6 t -58.16 -54.46 46.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.43 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.443 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 2.2 t30 -51.03 -63.4 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.497 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.44 -47.94 62.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.243 179.312 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' A' ' 29' ' ' ASP . 14.6 m-20 -50.81 -62.6 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.546 ' C ' ' H ' ' A' ' 28' ' ' LEU . 80.4 m -53.85 -41.4 67.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -59.99 7.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.063 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.546 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -162.36 -40.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.045 -179.375 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 25' ' ' ASP . 71.8 m-20 -67.35 -54.28 21.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.767 0.318 . . . . 0.0 111.004 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 1.3 mmmm -102.25 29.9 4.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.888 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 7.9 m170 33.09 39.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.427 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.01 -176.11 5.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.678 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -95.92 -26.12 15.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.07 0.462 . . . . 0.0 110.458 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.451 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -175.17 -159.14 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.07 -179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.451 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 164.72 -172.0 40.32 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.978 -1.106 . . . . 0.0 113.456 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 4.9 tt0 -177.07 -144.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.914 0.388 . . . . 0.0 110.521 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.09 133.84 17.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.648 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -149.66 -177.96 6.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.222 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -90.31 -166.79 1.67 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.863 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.515 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -176.41 -173.07 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.612 -179.755 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -60.52 -2.57 0.52 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.399 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' ' 44' ' ' ASN . 6.0 mmtp -100.81 -1.43 34.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.086 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 59.47 -2.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.243 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.56 ' H ' ' C ' ' A' ' 42' ' ' LYS . 2.1 m120 -94.97 158.81 15.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.695 0.283 . . . . 0.0 110.749 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mt -87.84 133.2 33.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -146.5 157.2 43.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.187 0.518 . . . . 0.0 111.363 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.639 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -70.77 157.33 38.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.121 -179.72 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -143.43 111.85 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.953 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.8 m -92.22 119.0 31.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.887 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -92.7 158.39 15.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.441 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -129.92 -36.11 1.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 34.5 m . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.918 -179.748 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.8 m . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.895 0.378 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 138.4 26.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.939 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.432 ' C ' ' CG1' ' A' ' 7' ' ' VAL . 3.6 mtpm? -147.84 -156.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.128 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.432 ' CG1' ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -168.52 158.84 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.627 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.13 114.31 22.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.034 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -65.42 4.91 0.47 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.412 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.627 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 9.3 p30 178.23 136.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.727 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.6 t80 -179.42 100.92 0.19 Allowed Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.928 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.642 ' O ' ' N ' ' A' ' 14' ' ' SER . 80.7 Cg_exo -45.39 65.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.885 2.39 . . . . 0.0 113.624 -178.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.727 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.4 t 8.98 51.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 123.967 0.907 . . . . 0.0 113.297 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.642 ' N ' ' O ' ' A' ' 12' ' ' PRO . 2.8 p -68.7 135.64 51.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 0.0 111.915 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 26.66 32.37 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.579 ' N ' ' O ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -71.52 82.05 0.81 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.469 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -161.53 -42.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.977 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -73.06 -103.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.501 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.52 22.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.506 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.591 ' O ' ' N ' ' A' ' 22' ' ' CYS . 18.5 t-20 -114.59 -112.16 0.34 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.021 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.563 ' C ' ' O ' ' A' ' 20' ' ' ASN . 11.6 mm-40 0.89 -68.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.775 0.672 . . . . 0.0 111.827 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 42.7 t -60.94 -68.15 0.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.694 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.5 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -47.17 -46.96 23.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.226 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.05 -48.97 78.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.096 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 21' ' ' GLN . 12.5 m-20 -52.37 -57.0 11.2 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.393 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.679 ' C ' ' H ' ' A' ' 28' ' ' LEU . 91.6 m -58.13 -44.05 87.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -61.43 11.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.54 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.699 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.2 tp -160.89 -134.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.071 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 40.41 -76.87 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.175 0.297 . . . . 0.0 111.77 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 28' ' ' LEU . 9.9 mmtp -90.6 -9.16 48.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 110.557 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.455 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 3.3 m170 79.91 49.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.206 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.92 -136.57 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.157 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -141.45 -53.63 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.665 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -155.92 133.34 10.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.641 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.45 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . -105.98 -157.19 22.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.5 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -172.14 131.54 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 87.2 m -90.36 123.3 33.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.724 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.436 ' CE1' ' CG1' ' A' ' 48' ' ' ILE . 23.2 p90 -149.16 140.7 23.39 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 120.513 -0.475 . . . . 0.0 112.017 -179.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -72.69 133.87 44.8 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.66 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 42' ' ' LYS . 13.1 p-10 -146.68 -166.13 2.41 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.458 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.488 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.4 tt0 22.23 42.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.186 -178.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.58 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.2 mtpt 68.96 83.05 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.207 178.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.4 ttp85 61.54 52.73 3.56 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.002 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -93.34 -60.31 1.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 11.9 tp 76.92 67.19 0.05 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.296 -178.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -91.87 -175.96 4.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.015 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -127.27 123.56 36.74 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.534 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -87.58 155.05 3.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.499 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.3 m -135.28 108.7 7.85 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.039 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -94.29 134.77 36.42 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -101.36 -24.67 14.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.93 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.1 m . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.019 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.231 0.083 0 CA-C-O 121.001 0.429 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.409 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -118.38 126.89 53.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.914 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.45 138.03 47.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.069 0.462 . . . . 0.0 111.787 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.407 HG22 ' H ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -61.41 146.98 11.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.62 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.609 ' O ' ' CG ' ' A' ' 8' ' ' TYR . 2.2 t80 -92.11 42.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.962 0.41 . . . . 0.0 110.429 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.543 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 4.5 pt-20 17.83 76.96 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.031 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.543 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 7.3 m120 103.74 145.41 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.059 0.849 . . . . 0.0 110.827 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 13' ' ' VAL . 39.4 t80 -179.32 123.7 0.24 Allowed Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.421 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_exo -41.75 82.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.293 1.995 . . . . 0.0 112.733 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.575 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.1 t -55.21 95.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 p -175.26 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -26.3 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.101 0.477 . . . . 0.0 110.123 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.449 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -68.09 90.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.735 179.236 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.416 ' H ' HD13 ' A' ' 18' ' ' LEU . 30.2 mt-30 -158.29 21.4 0.24 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.652 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.625 ' CD1' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -165.69 -79.55 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.739 0.304 . . . . 0.0 111.044 -179.588 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.537 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -178.01 -159.83 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 -178.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.501 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.2 OUTLIER 60.83 -72.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.381 -179.462 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 19' ' ' ALA . 6.0 mm-40 -39.49 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.6 t -59.57 -46.41 88.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.704 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -76.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.234 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.497 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.58 -43.33 35.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.467 179.926 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 29' ' ' ASP . 46.0 m-20 -50.37 -60.54 2.89 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.578 ' C ' ' H ' ' A' ' 28' ' ' LEU . 81.9 m -55.97 -39.53 71.94 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.275 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -59.69 7.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.836 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.8 tt -163.35 -26.07 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.638 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 25' ' ' ASP . 17.8 m-20 -70.03 -51.81 29.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 110.649 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 3.7 mmmm -110.21 0.24 18.1 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.969 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.499 ' CD2' ' N ' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 66.75 41.53 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.429 -179.594 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.83 -178.61 6.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.365 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -95.65 -10.57 29.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.071 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 174.67 -169.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.987 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.71 170.24 37.61 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.835 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.04 153.19 0.78 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -88.43 137.16 32.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.569 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -146.4 159.99 42.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -69.65 -168.64 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.612 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -161.64 156.69 23.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.461 0.648 . . . . 0.0 112.67 -179.782 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 40' ' ' ASP . 5.1 mm-40 11.73 -69.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.378 -1.283 . . . . 0.0 114.137 179.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -88.75 -57.1 3.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.388 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER 164.25 31.44 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.903 0.382 . . . . 0.0 110.02 -179.738 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.498 ' N ' HD21 ' A' ' 44' ' ' ASN . 0.9 OUTLIER -94.68 135.77 35.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.594 179.458 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -86.43 131.93 34.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.179 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.418 ' OE1' ' OD2' ' A' ' 40' ' ' ASP . 38.1 mt-30 -142.25 165.47 27.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.543 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.458 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -97.19 103.69 15.65 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.413 -179.494 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.9 mm -93.69 119.81 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.1 m -94.49 123.37 37.87 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.208 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -94.67 136.9 34.44 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.179 0.514 . . . . 0.0 111.373 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -110.68 -9.61 14.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.56 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.7 m . . . . . 0 N--CA 1.463 0.219 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.039 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 62.9 m . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.759 0.314 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.519 ' CB ' ' HZ1' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -100.15 118.95 37.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.451 179.461 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -149.82 115.8 5.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.053 0.454 . . . . 0.0 112.103 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -70.69 148.0 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.683 ' CD1' ' ND2' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -103.96 -7.44 20.37 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.027 179.58 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 8' ' ' TYR . 2.0 tm-20 30.23 104.82 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.105 -0.952 . . . . 0.0 112.095 -178.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.751 HD21 ' N ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER 170.5 -44.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.264 179.003 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.751 ' N ' HD21 ' A' ' 10' ' ' ASN . 55.0 t80 -53.62 139.37 49.98 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.737 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.517 ' C ' ' H ' ' A' ' 14' ' ' SER . 94.5 Cg_exo -39.59 95.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.081 1.854 . . . . 0.0 112.058 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.2 p -53.02 -7.17 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.517 ' H ' ' C ' ' A' ' 12' ' ' PRO . 96.9 p -65.25 -88.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.082 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.427 ' N ' ' OG ' ' A' ' 14' ' ' SER . 35.8 tptt -66.02 139.65 58.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.756 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.75 22.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.915 0.388 . . . . 0.0 110.974 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -113.77 57.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.185 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.586 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -168.88 124.99 0.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.96 54.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.552 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' A' ' 18' ' ' LEU . 9.8 t-20 -159.82 -73.81 0.07 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.442 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.581 ' O ' ' CB ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -53.05 90.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.969 179.299 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.581 ' CB ' ' O ' ' A' ' 21' ' ' GLN . 52.3 t 120.61 -57.95 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.613 1.196 . . . . 0.0 109.878 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 0.1 OUTLIER -56.5 -54.7 42.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.031 0.443 . . . . 0.0 109.854 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.519 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -55.18 -48.2 74.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.185 179.147 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -53.09 -51.27 62.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.069 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.655 ' C ' ' H ' ' A' ' 28' ' ' LEU . 22.2 m -56.27 -44.31 79.64 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.6 tttp -60.76 12.27 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.132 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.655 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -162.16 -129.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.664 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.462 ' N ' ' CD1' ' A' ' 28' ' ' LEU . 0.4 OUTLIER 40.05 -81.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.706 0.289 . . . . 0.0 111.292 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.648 ' N ' ' O ' ' A' ' 28' ' ' LEU . 18.0 mttm -95.3 5.25 52.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.5 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.563 ' N ' ' O ' ' A' ' 28' ' ' LEU . 3.3 m170 71.94 56.47 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.457 ' CB ' ' O ' ' A' ' 26' ' ' CYS . . . -89.58 177.53 6.52 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.494 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -96.78 -21.83 17.31 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.094 0.473 . . . . 0.0 109.864 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.494 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 1.5 p 158.59 137.86 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.049 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.439 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -128.67 -173.17 13.36 Favored Glycine 0 CA--C 1.51 -0.221 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.398 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -179.0 158.95 0.96 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 0.0 110.531 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.8 m -87.17 138.51 31.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.579 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -138.24 157.48 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.876 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -93.22 -169.76 2.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.794 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.595 ' C ' ' H ' ' A' ' 42' ' ' LYS . 30.2 p30 -166.58 -172.3 2.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -65.04 18.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.827 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.595 ' H ' ' C ' ' A' ' 40' ' ' ASP . 12.3 mmtp -138.25 17.89 2.78 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.929 0.395 . . . . 0.0 111.043 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.11 13.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.463 179.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.404 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 91.2 m-20 -94.67 141.33 28.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.808 0.337 . . . . 0.0 111.166 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 mt -87.78 147.35 25.21 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.943 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.404 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 2.5 mp0 -147.05 134.49 20.8 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.29 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . 1.5 m -77.42 102.19 6.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.435 0.636 . . . . 0.0 112.391 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.0 mt -89.28 117.34 32.44 Favored 'Isoleucine or valine' 0 C--N 1.341 0.208 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.077 178.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.2 m -93.97 115.61 27.98 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 110.101 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.465 ' OD2' ' O ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.05 129.24 44.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.447 0.642 . . . . 0.0 110.597 179.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -102.38 -12.41 17.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.001 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.051 -179.981 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.2 m . . . . . 0 CA--C 1.527 0.062 0 CA-C-O 120.684 0.278 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.9 pttt -146.26 131.47 18.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.852 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -145.44 124.94 13.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.409 . . . . 0.0 111.088 -179.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.04 129.28 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.43 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.97 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.604 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 176.13 -173.43 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.556 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.723 ' O ' ' O ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -19.51 -42.13 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.968 -179.756 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.723 ' O ' ' O ' ' A' ' 10' ' ' ASN . 59.1 t80 20.15 131.11 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.614 ' C ' ' H ' ' A' ' 14' ' ' SER . 49.0 Cg_endo -67.62 102.35 0.72 Allowed 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.98 1.787 . . . . 0.0 112.624 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.3 t -59.83 10.83 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.767 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.614 ' H ' ' C ' ' A' ' 12' ' ' PRO . 95.7 p -61.0 -5.58 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.599 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -166.78 127.85 1.65 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.016 0.436 . . . . 0.0 111.211 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 60.9 m -166.42 11.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.76 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.4 8.13 41.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.518 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.403 ' CD1' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -159.51 136.98 9.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.21 0.528 . . . . 0.0 110.495 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.406 ' HB2' HD21 ' A' ' 23' ' ' ASN . . . -59.41 113.85 2.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.667 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.519 ' O ' ' C ' ' A' ' 21' ' ' GLN . 0.6 OUTLIER -175.83 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.844 179.441 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.519 ' C ' ' O ' ' A' ' 20' ' ' ASN . 72.0 tp60 -16.34 -74.37 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.92 0.763 . . . . 0.0 112.009 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.534 ' N ' ' HH ' ' A' ' 11' ' ' TYR . 4.3 t -57.98 -49.25 77.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.513 ' N ' ' O ' ' A' ' 20' ' ' ASN . 44.8 t-20 -53.8 -69.56 0.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.144 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -38.96 32.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.562 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 29' ' ' ASP . 13.9 m-20 -55.45 -63.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.394 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.503 ' C ' ' H ' ' A' ' 28' ' ' LEU . 16.4 m -56.38 -38.95 72.15 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.57 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.196 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.503 ' H ' ' C ' ' A' ' 26' ' ' CYS . 3.3 tm? -163.24 -41.17 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.5 -0.48 . . . . 0.0 112.046 -179.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.551 ' N ' ' O ' ' A' ' 25' ' ' ASP . 96.6 m-20 -68.26 -16.44 63.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 110.895 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -143.33 22.69 1.85 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.237 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 40.74 39.58 0.8 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.11 0.481 . . . . 0.0 111.131 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.37 -173.79 4.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.846 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.55 -40.74 9.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.229 0.537 . . . . 0.0 110.494 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -161.28 175.46 12.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.686 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -158.77 146.58 13.33 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.408 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -175.73 156.52 1.86 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.419 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 2.8 m -88.38 145.19 25.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.432 0.634 . . . . 0.0 112.553 -178.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -143.3 163.37 33.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.437 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.4 166.75 22.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.707 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.487 ' O ' ' C ' ' A' ' 41' ' ' GLU . 2.1 p30 -171.53 176.11 3.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.635 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.487 ' C ' ' O ' ' A' ' 40' ' ' ASP . 69.7 mm-40 15.42 -90.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.687 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 mtpt -99.68 63.8 1.25 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.734 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 40.41 50.18 2.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.374 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.28 121.25 42.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.553 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.77 86.65 7.35 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -99.36 144.36 28.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.226 -178.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.672 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -63.02 101.42 0.27 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.322 179.601 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mt -92.59 120.79 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.108 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.4 m -92.47 116.3 28.87 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.26 139.65 30.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.245 0.545 . . . . 0.0 111.281 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -109.42 -22.47 12.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.296 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.318 . . . . 0.0 111.27 -179.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.456 -0.172 0 CA-C-O 120.697 0.284 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.911 0.386 . . . . 0.0 111.513 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.43 ' C ' ' CG1' ' A' ' 7' ' ' VAL . 38.8 mttt -144.99 -164.46 1.93 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.301 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.43 ' CG1' ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -167.69 157.16 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.432 . . . . 0.0 110.971 -179.42 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.604 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.86 107.78 17.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.991 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.49 4.88 0.33 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.604 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 4.9 p30 172.96 123.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.987 0.423 . . . . 0.0 110.701 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.558 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER 178.66 156.79 0.6 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.439 -179.843 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.404 ' C ' ' O ' ' A' ' 11' ' ' TYR . 41.5 Cg_exo -30.11 84.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 123.31 2.674 . . . . 0.0 112.939 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.558 ' N ' ' O ' ' A' ' 11' ' ' TYR . 8.8 t -57.2 -36.74 52.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.546 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.33 -49.96 73.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.028 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -64.48 99.13 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.964 0.411 . . . . 0.0 110.388 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -172.08 110.64 0.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.286 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.495 ' O ' ' O ' ' A' ' 18' ' ' LEU . 75.7 mt-30 -137.36 52.85 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.583 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 20.8 mt 32.87 97.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.98 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.583 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 99.99 146.48 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 O-C-N 123.679 0.612 . . . . 0.0 111.422 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.61 ' C ' ' H ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER 63.66 -79.3 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.671 179.359 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.53 39.99 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.61 ' H ' ' C ' ' A' ' 20' ' ' ASN . 9.9 t -179.58 -52.82 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.441 ' C ' ' OD1' ' A' ' 23' ' ' ASN . 10.8 t-20 -58.26 -54.24 49.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.146 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.523 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -57.39 -44.36 84.43 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.71 178.868 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 29' ' ' ASP . 0.1 OUTLIER -54.3 -58.64 6.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.521 179.729 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.589 ' C ' ' H ' ' A' ' 28' ' ' LEU . 85.1 m -55.11 -42.1 72.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -62.28 12.26 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.697 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.589 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.2 tp -162.86 -44.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.631 -179.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.641 ' N ' ' O ' ' A' ' 25' ' ' ASP . 94.1 m-20 -68.34 -17.41 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.056 0.455 . . . . 0.0 110.496 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.429 ' NZ ' ' O ' ' A' ' 7' ' ' VAL . 41.8 mttt -140.24 3.63 1.97 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.05 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.4 m170 53.23 35.9 21.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.965 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.46 -167.76 1.99 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -97.17 -44.75 6.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.023 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 84.0 p -157.69 -155.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.099 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 158.23 -171.53 35.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.448 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -175.98 162.61 2.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.933 0.397 . . . . 0.0 111.123 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 73.3 m -88.81 138.1 31.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.092 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -148.74 146.82 28.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.922 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -86.36 160.64 19.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.622 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -93.33 -172.92 3.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.618 179.587 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -65.49 19.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.54 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.622 ' H ' ' C ' ' A' ' 40' ' ' ASP . 13.4 mtpp -140.93 -73.41 0.34 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.092 179.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.453 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 9.8 mtp85 153.45 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.644 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.47 ' O ' ' O ' ' A' ' 45' ' ' LEU . 0.7 OUTLIER -109.48 -0.25 18.95 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -178.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.47 ' O ' ' O ' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 57.3 136.77 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.752 0.311 . . . . 0.0 111.074 179.791 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -147.78 170.62 17.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.837 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.12 108.99 13.98 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.095 0.474 . . . . 0.0 111.515 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.9 mt -87.06 129.25 38.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.51 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.5 m -110.11 118.73 37.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.853 0.358 . . . . 0.0 111.187 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -96.55 152.95 18.15 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.794 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -130.23 3.62 4.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.958 -179.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 40.9 m . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.423 -179.954 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-O 120.78 0.324 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.457 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -141.11 113.99 8.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.435 179.828 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -98.54 125.36 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.189 -179.098 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.98 146.25 13.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.626 178.801 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.57 84.22 6.81 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.096 0.474 . . . . 0.0 109.8 179.246 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.585 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -67.08 113.91 5.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.687 179.839 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.585 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 23.3 t-20 117.17 -34.25 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 O-C-N 124.144 0.902 . . . . 0.0 110.698 179.835 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.577 ' O ' ' O ' ' A' ' 12' ' ' PRO . 38.2 t80 -41.25 140.32 1.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.241 -179.995 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.577 ' O ' ' O ' ' A' ' 11' ' ' TYR . 72.6 Cg_exo -48.22 -146.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.413 2.075 . . . . 0.0 113.408 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.431 ' CG2' ' C ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -169.99 74.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.449 -179.984 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.9 p -174.17 -64.93 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -67.72 97.28 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.256 179.103 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 0.8 OUTLIER -170.97 113.0 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.44 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mm-40 156.72 -48.85 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.897 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' C ' ' A' ' 19' ' ' ALA . 10.9 mt -71.16 52.86 0.17 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.004 -179.542 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.544 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 3.78 84.97 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.974 0.797 . . . . 0.0 112.26 179.313 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.485 ' O ' ' C ' ' A' ' 21' ' ' GLN . 2.7 t-20 -164.18 -96.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.283 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.485 ' C ' ' O ' ' A' ' 20' ' ' ASN . 16.2 mm-40 -28.88 -76.8 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.489 -179.514 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.2 t -48.12 -64.95 0.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.904 0.383 . . . . 0.0 111.616 -179.735 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.504 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 2.8 t30 -47.63 -70.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.681 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -50.61 -43.32 56.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.3 m-20 -51.77 -65.59 0.53 Allowed 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.509 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.443 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.5 m -52.8 -42.08 64.74 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.068 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.9 tttp -59.14 1.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.747 -179.698 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.443 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.0 tt -167.81 -44.8 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.732 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 14.3 m-20 -64.62 -2.19 2.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.944 0.402 . . . . 0.0 110.78 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.421 ' H ' ' C ' ' A' ' 28' ' ' LEU . 37.7 mttm -144.75 8.58 1.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.33 179.338 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 53.48 36.03 22.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.768 179.978 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.11 -178.21 5.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 111.451 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.452 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -93.68 -31.32 14.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.465 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.1 p -176.72 -160.9 0.07 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.776 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.504 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 146.68 173.41 17.89 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.249 -0.977 . . . . 0.0 112.775 179.615 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.415 ' HG3' ' H ' ' A' ' 37' ' ' CYS . 0.4 OUTLIER -176.49 179.01 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.844 0.354 . . . . 0.0 110.652 179.964 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.415 ' H ' ' HG3' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -87.44 103.29 15.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.531 179.712 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -95.22 152.49 18.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.417 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.635 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 20.0 m-85 -96.5 -166.8 1.47 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.287 179.269 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.619 ' C ' ' H ' ' A' ' 42' ' ' LYS . 14.1 p-10 -133.68 -174.06 3.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.815 0.34 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.69 28.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.858 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.619 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -145.6 -81.76 0.15 Allowed 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.268 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.08 39.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.441 179.142 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.635 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 2.7 m120 -90.17 -168.1 2.03 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.143 -179.315 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 7.7 mt -152.3 133.64 14.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 111.619 -179.552 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -148.51 137.81 21.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.114 179.065 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.09 96.2 6.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.96 0.41 . . . . 0.0 111.217 -179.351 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.72 114.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.713 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -93.14 115.06 27.72 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -87.92 142.94 27.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.969 0.414 . . . . 0.0 111.584 -178.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -118.01 -27.26 6.18 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.485 -179.663 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.276 -179.358 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 120.738 0.304 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm -138.0 129.08 27.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -148.89 126.47 11.68 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.815 0.341 . . . . 0.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -63.22 158.28 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.338 179.055 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.463 ' O ' ' C ' ' A' ' 9' ' ' GLU . 23.5 t80 -82.64 -15.75 50.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.055 0.455 . . . . 0.0 111.433 -179.368 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.463 ' C ' ' O ' ' A' ' 8' ' ' TYR . 1.9 pt-20 26.57 78.8 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.724 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.417 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 3.7 m-20 165.1 -41.23 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.204 179.513 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -52.16 108.86 1.18 Allowed Pre-proline 0 CA--C 1.535 0.401 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.593 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.615 ' O ' ' N ' ' A' ' 14' ' ' SER . 94.2 Cg_endo -81.57 70.41 7.32 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.179 1.919 . . . . 0.0 112.299 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.495 ' C ' ' O ' ' A' ' 12' ' ' PRO . 2.6 t 18.85 44.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 123.85 0.719 . . . . 0.0 112.142 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.615 ' N ' ' O ' ' A' ' 12' ' ' PRO . 3.7 p -67.42 -7.58 26.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.512 -179.929 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.494 ' O ' ' C ' ' A' ' 16' ' ' CYS . 30.0 tptt -172.35 -88.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.381 -179.712 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.5 OUTLIER 26.37 97.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.397 -179.787 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -144.17 1.76 1.11 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.157 -179.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mt -164.24 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.297 -179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 176.58 109.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.794 -179.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -179.13 -82.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.336 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.452 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 3.3 tp60 -46.45 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.224 -179.414 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.28 -40.18 85.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.523 -179.57 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -53.23 -65.94 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.41 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.563 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -52.24 -42.2 63.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.033 178.882 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.9 m-20 -50.79 -60.73 2.75 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.815 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.527 ' C ' ' H ' ' A' ' 28' ' ' LEU . 57.0 m -54.86 -49.9 70.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 178.379 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 17.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.869 179.503 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 26' ' ' CYS . 3.5 tm? -165.47 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.018 -0.673 . . . . 0.0 112.262 -179.395 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.643 ' N ' ' O ' ' A' ' 25' ' ' ASP . 11.0 m-20 -67.77 -11.73 59.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.743 0.306 . . . . 0.0 111.16 -179.507 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 31' ' ' HIS . 24.9 mttm -139.14 27.21 2.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.849 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.597 ' N ' ' CD2' ' A' ' 31' ' ' HIS . 0.0 OUTLIER 34.71 38.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.287 0.565 . . . . 0.0 110.328 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 30' ' ' LYS . . . -83.7 176.75 8.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.814 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -92.81 -27.62 17.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.8 p 177.96 -165.08 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.497 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.77 -176.88 47.58 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.476 -179.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -175.49 157.57 2.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.882 0.372 . . . . 0.0 110.962 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -90.7 104.38 16.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.603 -179.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -96.19 171.54 8.54 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.53 ' O ' ' O ' ' A' ' 40' ' ' ASP . 3.5 m-85 -99.11 -8.84 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.626 0.251 . . . . 0.0 111.039 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.565 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.4 OUTLIER 50.43 161.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.0 111.276 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -63.98 8.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.094 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.565 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -105.35 -23.72 12.8 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-O 120.9 0.381 . . . . 0.0 110.578 -179.982 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 66.29 52.2 1.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.665 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -139.24 12.22 2.59 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.825 0.345 . . . . 0.0 111.492 -179.641 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.7 tp 64.79 122.36 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -143.19 155.05 44.45 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.832 179.228 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 98.7 m -98.47 113.13 25.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.981 0.42 . . . . 0.0 112.016 -179.136 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -91.8 117.01 34.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.569 179.607 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.9 m -94.95 112.15 23.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -94.85 154.21 17.35 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -131.04 -22.34 2.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.438 -179.017 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.214 0 CA-C-O 120.724 0.297 . . . . 0.0 110.948 -179.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.054 0.455 . . . . 0.0 110.671 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -97.23 121.45 39.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.889 179.859 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.405 ' HB3' ' HZ1' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -136.73 126.1 24.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.064 0.459 . . . . 0.0 111.144 -179.984 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.5 m -62.36 149.52 9.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.014 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' O ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -51.01 -103.44 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.7 179.19 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 178.13 -14.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.378 -0.201 . . . . 0.0 111.484 179.445 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -178.01 21.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.326 . . . . 0.0 110.996 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.491 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 49.8 t80 -56.01 113.54 5.96 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.02 99.23 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.077 1.851 . . . . 0.0 112.256 179.926 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -53.7 92.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.39 179.759 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.556 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 0.6 OUTLIER -175.46 128.5 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.797 -179.702 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 14' ' ' SER . 2.9 tptt 92.62 -13.35 0.17 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.631 -179.82 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m -66.56 70.61 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.728 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' A' ' 15' ' ' LYS . 10.3 mp0 -114.43 -15.62 12.05 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.376 -179.734 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.434 ' O ' ' O ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -162.11 176.27 10.87 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.93 0.395 . . . . 0.0 110.349 -179.843 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -56.7 -149.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.639 -179.837 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 61.55 -79.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.262 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.491 ' OE1' ' OH ' ' A' ' 11' ' ' TYR . 7.8 tp-100 -41.18 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.153 -179.645 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 t -59.36 -41.89 90.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.22 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.21 -74.16 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.009 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.539 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -49.33 -40.12 34.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.529 179.92 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 7.7 m-20 -55.64 -65.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.137 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.9 m -56.33 -35.93 68.17 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.906 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttpp -59.86 2.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.93 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 26' ' ' CYS . 13.2 tp -165.14 -36.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.0 m-20 -67.86 -14.17 62.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -141.38 16.9 2.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.756 179.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.4 m80 53.2 29.11 7.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.62 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.46 -175.61 5.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.634 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -98.41 -50.34 4.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 -179.82 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.0 OUTLIER -141.43 -173.58 3.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.323 179.595 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.457 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . -168.21 166.38 39.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.063 -1.065 . . . . 0.0 113.363 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -177.2 146.68 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.05 138.43 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.993 0.425 . . . . 0.0 111.527 -179.453 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.19 158.1 43.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.644 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.563 ' CE2' ' CD2' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -81.93 155.26 25.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.839 179.77 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.55 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 4.6 p-10 -161.5 58.62 0.28 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.832 0.348 . . . . 0.0 111.688 -179.885 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 19.1 tp10 93.34 -16.86 0.12 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.47 -0.787 . . . . 0.0 111.579 178.685 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.61 -7.53 34.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.234 -179.221 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? 40.11 39.87 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.236 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -143.64 5.58 1.4 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.563 ' CD2' ' CE2' ' A' ' 39' ' ' TYR . 1.0 OUTLIER 71.65 152.67 0.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.192 179.441 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -149.09 137.4 20.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.163 179.483 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 98.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 43.0 mm -89.82 113.29 25.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.2 m -92.36 129.84 38.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.079 0.466 . . . . 0.0 111.231 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -96.13 125.17 40.47 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.689 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -98.92 -27.44 13.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.752 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.8 m . . . . . 0 C--N 1.331 -0.217 0 CA-C-O 121.184 0.516 . . . . 0.0 110.867 179.741 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.53 0.205 0 CA-C-O 120.399 0.142 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -87.7 143.29 27.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.312 0.577 . . . . 0.0 112.037 -178.782 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -147.88 122.16 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.922 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.74 149.89 5.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.477 ' N ' ' O ' ' A' ' 47' ' ' CYS . 0.3 OUTLIER -105.86 76.65 1.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.875 -1.057 . . . . 0.0 108.305 177.719 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 11' ' ' TYR . 1.6 pt-20 -47.63 -94.0 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.689 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -47.18 92.76 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.377 178.877 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.496 ' N ' ' O ' ' A' ' 9' ' ' GLU . 67.1 t80 -177.8 107.29 0.22 Allowed Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.05 -179.099 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.551 ' O ' ' N ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.57 124.36 8.05 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.351 2.034 . . . . 0.0 112.276 179.925 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.425 ' O ' ' CG1' ' A' ' 13' ' ' VAL . 40.8 t -60.57 45.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.938 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.551 ' N ' ' O ' ' A' ' 12' ' ' PRO . 78.5 p -63.3 -125.86 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.476 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -68.64 151.91 46.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.335 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.498 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -173.27 -32.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.205 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -74.19 38.93 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.608 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.498 ' H ' ' C ' ' A' ' 16' ' ' CYS . 27.4 mt -161.91 -102.58 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.828 -179.639 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -179.62 -153.69 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.415 -179.443 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.74 -82.49 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.417 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.481 ' CA ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -33.82 -76.46 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.475 -179.979 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.91 -52.34 65.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.244 0.545 . . . . 0.0 110.661 179.242 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -78.25 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.32 -179.623 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -44.87 -48.98 11.15 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.832 -179.361 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 29' ' ' ASP . 5.0 m-20 -52.88 -65.77 0.5 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.442 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.513 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -57.34 -29.9 64.37 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.52 -179.854 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.84 1.54 0.14 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.071 179.131 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.513 ' H ' ' C ' ' A' ' 26' ' ' CYS . 23.6 tp -162.44 -31.73 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.391 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 25' ' ' ASP . 66.5 m-20 -68.63 -17.56 64.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.202 0.525 . . . . 0.0 110.019 179.448 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -141.93 -1.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.54 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.3 m80 63.73 42.15 6.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.791 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.03 -173.62 4.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 8.1 ttp180 -98.99 -56.5 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.999 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 48.4 p -167.55 135.34 2.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.038 -179.931 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -123.28 -165.13 12.25 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.42 -0.895 . . . . 0.0 114.983 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -176.14 -145.77 0.02 OUTLIER 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.16 -1.02 . . . . 0.0 109.118 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.17 137.55 20.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.655 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.537 ' CD2' ' CD1' ' A' ' 48' ' ' ILE . 19.6 m-85 -142.21 157.07 45.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.304 178.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.532 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 17.2 m-85 -72.08 169.3 16.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.433 -179.582 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -162.9 -158.94 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.436 -179.488 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -62.88 -11.26 17.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.828 -179.36 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.622 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -94.62 10.15 35.96 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.084 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 52.33 2.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.983 0.421 . . . . 0.0 111.144 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.622 ' H ' ' C ' ' A' ' 42' ' ' LYS . 4.0 m120 -100.88 -136.04 0.31 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.619 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.459 ' N ' ' CD2' ' A' ' 45' ' ' LEU . 0.2 OUTLIER -152.39 118.47 5.5 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.317 0.579 . . . . 0.0 111.183 179.053 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -97.26 152.03 19.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.548 -179.601 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -78.18 113.38 16.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.665 179.617 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.537 ' CD1' ' CD2' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -101.31 113.0 36.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.739 -179.693 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.3 m -99.11 134.56 41.78 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.338 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.2 t70 -95.2 115.81 27.92 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.849 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -103.43 57.0 0.74 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.648 -179.224 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.158 -179.531 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 121.134 0.492 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.05 155.99 43.16 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.791 179.275 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -151.01 110.24 3.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.017 0.437 . . . . 0.0 111.198 -179.698 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.6 m -66.45 144.84 14.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.239 179.876 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.553 ' O ' ' CG ' ' A' ' 9' ' ' GLU . 1.9 t80 -63.13 -75.52 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.484 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.58 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.3 pp20? 104.26 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 O-C-N 124.649 1.218 . . . . 0.0 112.074 178.466 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.58 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 10.4 t-20 107.89 -12.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.346 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.413 ' HH ' ' HG3' ' A' ' 21' ' ' GLN . 48.4 t80 -52.92 113.49 4.65 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.847 -179.941 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -42.73 112.48 0.27 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.014 1.81 . . . . 0.0 112.101 179.812 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.507 ' O ' ' C ' ' A' ' 14' ' ' SER . 69.4 t -52.7 -70.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.507 ' C ' ' O ' ' A' ' 13' ' ' VAL . 20.6 p 21.28 -95.04 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.669 179.974 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -69.82 108.95 4.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.477 179.667 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.27 57.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -141.54 22.46 2.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.82 179.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -167.81 125.87 1.21 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.53 179.947 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.24 99.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.627 -179.785 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.495 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.5 OUTLIER -175.98 -68.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.603 179.293 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.416 ' C ' HE21 ' A' ' 21' ' ' GLN . 2.8 tp60 -47.99 -74.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.873 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.8 t -58.52 -40.52 83.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.181 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -53.49 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 -179.674 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.554 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.37 -45.39 62.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.344 179.998 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.439 ' O ' ' N ' ' A' ' 29' ' ' ASP . 0.6 OUTLIER -50.55 -64.48 0.8 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.835 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.483 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.2 m -54.45 -33.61 59.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -61.89 3.37 0.16 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.591 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.483 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.9 OUTLIER -164.35 -27.26 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.531 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.4 m-20 -70.02 -29.67 66.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.789 0.328 . . . . 0.0 110.993 -179.899 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.482 ' O ' ' OH ' ' A' ' 51' ' ' TYR . 1.8 mtmp? -141.66 40.88 1.71 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.957 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.448 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.4 m80 31.73 44.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.363 179.864 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.12 179.27 6.17 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.92 0.39 . . . . 0.0 111.244 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.409 HH11 ' HG3' ' A' ' 33' ' ' ARG . 34.9 ttm-85 -96.15 -20.31 18.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.984 179.406 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.0 p 177.84 -176.24 0.18 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.241 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.6 167.87 36.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.796 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -177.24 157.21 1.32 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.805 0.336 . . . . 0.0 110.44 179.766 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -89.53 106.16 18.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.43 -179.369 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -107.96 151.28 26.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.897 179.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -81.13 177.17 9.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.935 0.398 . . . . 0.0 111.592 -179.76 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 42' ' ' LYS . 1.4 p30 -167.94 95.24 0.42 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.01 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' A' ' 40' ' ' ASP . 14.4 tt0 27.02 32.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.263 -179.908 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.641 ' N ' ' O ' ' A' ' 40' ' ' ASP . 16.9 mtpp -147.19 0.76 0.72 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.24 179.815 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 61.89 0.98 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.022 0.439 . . . . 0.0 110.283 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.59 ' ND2' ' O ' ' A' ' 42' ' ' LYS . 1.9 m120 -92.94 133.35 36.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.152 179.456 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.44 117.49 25.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.569 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -100.63 141.45 33.48 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.086 178.653 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.88 94.26 1.41 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.96 0.409 . . . . 0.0 111.42 -179.682 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.8 mt -90.13 120.32 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.562 179.58 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.4 m -92.75 114.97 27.68 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 178.927 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.69 135.49 33.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.978 0.418 . . . . 0.0 111.246 -179.254 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.482 ' OH ' ' O ' ' A' ' 30' ' ' LYS . 10.7 m-85 -109.66 -21.84 12.23 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.047 -178.891 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.4 m . . . . . 0 C--N 1.332 -0.177 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.828 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.248 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -96.48 132.86 41.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.16 0.505 . . . . 0.0 111.906 -179.227 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -146.83 134.79 21.41 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.76 179.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.478 ' O ' ' OE2' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -65.2 154.75 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.441 -179.919 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.475 ' OH ' ' OD2' ' A' ' 29' ' ' ASP . 1.0 OUTLIER -92.68 85.06 5.13 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.397 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.544 ' O ' ' C ' ' A' ' 10' ' ' ASN . 1.0 OUTLIER -58.1 171.6 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 -178.917 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.544 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 16.02 101.09 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.599 0.562 . . . . 0.0 111.568 -179.389 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.5 OUTLIER 175.91 141.13 0.21 Allowed Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.037 -178.92 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.4 ' HB3' ' HZ3' ' A' ' 15' ' ' LYS . 56.8 Cg_exo -34.03 80.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.948 2.432 . . . . 0.0 113.07 -179.604 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.62 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.8 p -60.23 -27.06 38.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.448 179.841 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.42 -45.93 90.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.329 -179.39 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.4 ' HZ3' ' HB3' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -65.42 82.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.04 0.448 . . . . 0.0 110.614 -179.782 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -173.64 95.08 0.1 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 179.867 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.43 -34.15 3.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.933 179.552 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.0 mt -164.69 -175.21 3.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.304 179.852 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.559 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -53.82 177.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.376 -179.963 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 19' ' ' ALA . 0.2 OUTLIER 96.93 -85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.778 179.697 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -50.82 -70.04 0.1 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.699 0.285 . . . . 0.0 111.66 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.558 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.3 t -53.93 -45.15 71.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.17 -179.481 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -55.47 -66.9 0.34 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.061 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.55 -47.44 57.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.817 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.454 ' O ' ' C ' ' A' ' 28' ' ' LEU . 2.2 m-20 -52.67 -51.11 61.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.555 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.675 ' C ' ' H ' ' A' ' 28' ' ' LEU . 87.4 m -57.88 -40.79 81.07 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.585 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -57.46 -0.45 0.06 Allowed 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 177.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.683 ' C ' ' H ' ' A' ' 30' ' ' LYS . 10.1 tp -162.96 -139.39 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.202 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.475 ' OD2' ' OH ' ' A' ' 8' ' ' TYR . 3.7 m-20 65.24 -50.39 0.36 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 -177.16 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.683 ' H ' ' C ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -126.06 -85.97 0.62 Allowed 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.389 175.772 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.578 ' CD2' ' O ' ' A' ' 30' ' ' LYS . 1.3 p80 169.13 54.16 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.41 178.053 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.05 179.73 6.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.799 179.468 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.28 -33.46 12.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.184 0.516 . . . . 0.0 110.482 -179.991 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.6 p -166.42 -162.57 0.53 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.569 -0.742 . . . . 0.0 109.811 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 177.72 -168.58 40.16 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 119.693 -1.242 . . . . 0.0 113.471 179.847 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.558 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.7 OUTLIER -177.06 -158.54 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -179.921 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.32 144.79 26.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 111.508 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.449 ' O ' ' N ' ' A' ' 46' ' ' GLN . 57.5 m-85 -144.77 159.97 42.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.198 -179.705 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.596 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 3.1 m-85 -84.44 173.97 10.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.683 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -153.85 -171.4 3.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.929 0.395 . . . . 0.0 111.133 -179.769 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -12.93 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.533 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' ' C ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -95.04 25.88 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.887 -179.912 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 29.55 55.2 0.13 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.192 179.566 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 75.6 m-20 -141.8 -125.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.704 179.701 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.543 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -148.78 162.43 39.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.318 . . . . 0.0 110.592 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 38' ' ' PHE . 20.1 mt-30 -148.3 114.57 5.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.704 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -68.52 102.95 1.56 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.453 -179.513 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.6 mm -89.09 114.89 27.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.06 179.304 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.8 m -98.0 119.21 36.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.988 0.423 . . . . 0.0 110.894 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.13 130.02 44.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.176 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -95.56 -21.67 18.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.963 -179.613 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.6 m . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.947 -179.752 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.534 0.343 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.34 148.73 40.17 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.915 0.388 . . . . 0.0 110.355 179.71 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -150.36 125.56 10.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.881 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -65.58 150.13 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-O 120.837 0.351 . . . . 0.0 111.063 179.768 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.503 ' O ' ' O ' ' A' ' 9' ' ' GLU . 30.2 t80 -100.19 -10.92 20.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.214 0.531 . . . . 0.0 110.888 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.563 ' O ' ' C ' ' A' ' 10' ' ' ASN . 2.0 pm0 34.31 -158.04 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.64 -179.576 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.563 ' C ' ' O ' ' A' ' 9' ' ' GLU . 37.2 t-20 2.42 102.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.671 0.607 . . . . 0.0 111.863 -179.719 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.3 OUTLIER 179.97 141.13 0.32 Allowed Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.561 -179.197 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -40.03 90.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.232 1.955 . . . . 0.0 112.409 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.639 ' O ' ' N ' ' A' ' 15' ' ' LYS . 54.7 t -52.87 -90.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.361 179.863 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.496 ' C ' ' O ' ' A' ' 13' ' ' VAL . 60.7 p 9.96 -70.21 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.864 0.728 . . . . 0.0 112.866 179.206 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -60.28 89.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.997 -179.546 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 116.92 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.356 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -114.15 -54.16 2.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.569 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.4 mt -174.2 -20.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.918 179.467 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 178.7 104.24 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.631 -179.693 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.562 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -175.64 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.163 179.709 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.439 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 30.7 mm100 -50.71 -52.05 43.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.802 -179.772 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.65 -59.29 5.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 179.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.525 HD21 ' C ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -49.8 -63.68 1.04 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.57 -179.833 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -48.7 69.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.312 179.564 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.49 ' O ' ' N ' ' A' ' 29' ' ' ASP . 23.7 m-20 -49.24 -65.14 0.62 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.5 179.816 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.592 ' C ' ' H ' ' A' ' 28' ' ' LEU . 62.7 m -49.93 -41.99 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.326 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -61.0 10.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.659 179.169 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.592 ' H ' ' C ' ' A' ' 26' ' ' CYS . 11.3 tp -163.14 -30.1 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.684 0.278 . . . . 0.0 111.711 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -70.0 -61.35 1.81 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.345 179.776 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.84 19.17 14.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 53.2 32.94 14.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 -179.31 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.28 -177.35 6.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.784 -179.431 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.0 -42.06 8.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.767 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.3 p -154.85 -156.44 0.67 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.842 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 171.2 -175.91 44.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.569 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -177.78 155.82 1.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.459 ' SG ' ' O ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -87.43 155.48 20.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.876 0.369 . . . . 0.0 110.899 179.99 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -146.65 121.13 9.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.808 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.634 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 34.8 m-85 -70.87 -93.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.245 179.555 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.54 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER 53.94 147.65 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.499 0.666 . . . . 0.0 111.694 179.409 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.54 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 2.6 tt0 89.62 -79.22 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.728 178.299 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.63 73.65 1.19 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.201 -178.792 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.58 38.78 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.296 179.314 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.634 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 54.1 m-80 -92.77 -163.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.132 179.76 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 9.2 mt -155.23 98.22 1.98 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.786 0.327 . . . . 0.0 111.266 179.984 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.459 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 78.1 mt-30 -94.79 170.51 9.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.018 179.148 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.8 109.46 15.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.042 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mm -92.68 121.62 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.55 179.367 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.93 122.58 43.07 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.647 0.26 . . . . 0.0 110.63 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.85 141.63 28.29 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.91 0.386 . . . . 0.0 110.63 -179.996 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -114.75 -12.83 12.1 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.907 -179.102 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.242 0 CA-C-O 120.624 0.25 . . . . 0.0 111.374 -179.388 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.138 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -95.42 135.92 36.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 113.83 7.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.998 0.427 . . . . 0.0 111.331 -179.434 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -65.3 135.93 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.458 179.228 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.583 ' C ' ' H ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -64.82 106.61 1.25 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.902 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 10' ' ' ASN . 8.5 mt-10 -63.06 43.16 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.324 -178.785 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.583 ' H ' ' C ' ' A' ' 8' ' ' TYR . 1.3 m120 172.42 -97.75 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.561 179.878 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.519 ' C ' ' O ' ' A' ' 10' ' ' ASN . 8.2 t80 8.52 76.37 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.423 0 O-C-N 123.733 0.645 . . . . 0.0 112.63 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.542 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.6 Cg_exo -62.66 109.66 0.94 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.985 2.457 . . . . 0.0 112.026 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.555 ' O ' ' CB ' ' A' ' 14' ' ' SER . 21.6 t 8.75 -108.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 O-C-N 123.845 0.716 . . . . 0.0 112.039 179.946 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 13' ' ' VAL . 5.1 p 91.33 -45.15 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.754 0.312 . . . . 0.0 111.457 179.124 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -172.56 74.94 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.977 0.418 . . . . 0.0 110.874 -178.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -66.44 -59.9 3.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.893 -179.689 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.596 ' O ' ' N ' ' A' ' 19' ' ' ALA . 0.9 OUTLIER 61.5 10.81 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.738 179.207 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.432 ' C ' ' O ' ' A' ' 17' ' ' GLN . 6.5 mp 30.79 30.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' A' ' 17' ' ' GLN . . . 175.99 35.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.732 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER -166.47 -141.29 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.518 179.537 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.548 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER 2.62 -69.37 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 124.008 0.817 . . . . 0.0 111.981 179.721 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.586 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.1 t -58.94 -65.71 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.023 179.57 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' ASN . 44.4 t-20 -51.29 -54.81 22.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.958 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -54.33 -44.63 72.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.137 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 78.6 m-20 -57.28 -64.79 0.77 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.219 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.507 ' C ' ' H ' ' A' ' 28' ' ' LEU . 58.1 m -52.78 -51.46 60.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.742 179.846 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -59.72 10.55 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.816 -179.799 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.507 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.82 -52.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 119.998 -0.681 . . . . 0.0 112.72 -179.495 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.5 OUTLIER -66.72 -7.57 21.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.578 0.228 . . . . 0.0 111.474 -179.12 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.46 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -141.81 24.84 2.01 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.952 0.406 . . . . 0.0 110.378 179.448 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.7 m80 38.46 38.91 0.27 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.037 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.16 -176.35 5.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.827 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -95.85 -45.27 7.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.384 179.825 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.474 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 2.7 p -168.93 130.96 1.24 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.92 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -101.98 174.88 24.71 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.33 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -174.92 138.31 0.46 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.982 0.42 . . . . 0.0 110.583 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.2 m -89.48 113.12 24.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.416 -179.453 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -97.98 141.54 30.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.423 179.297 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.494 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 9.5 m-85 -83.26 -169.67 2.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.936 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.562 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 2.9 p-10 -173.59 156.03 2.87 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.346 0.593 . . . . 0.0 112.04 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.464 ' C ' ' O ' ' A' ' 40' ' ' ASP . 21.9 mt-10 16.92 -82.27 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.103 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.9 mptt -91.64 60.87 4.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.232 0.539 . . . . 0.0 110.943 -178.917 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.467 ' C ' ' O ' ' A' ' 42' ' ' LYS . 28.3 mmt180 29.04 60.44 0.14 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.584 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.494 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.6 OUTLIER -95.39 -154.53 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.792 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.7 mp -155.23 140.73 17.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.844 0.354 . . . . 0.0 110.995 179.545 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -143.05 131.81 22.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.252 179.834 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.66 101.73 4.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.358 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.7 mt -95.84 114.31 32.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.474 178.194 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.46 ' SG ' ' NZ ' ' A' ' 30' ' ' LYS . 91.7 m -94.73 118.8 32.32 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.301 179.364 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.1 t0 -94.45 118.3 31.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.452 0.644 . . . . 0.0 111.212 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -99.21 -89.65 0.31 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.029 179.6 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.4 m . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.032 179.53 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.806 0.336 . . . . 0.0 110.752 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.92 97.01 3.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.411 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.4 mttt -93.72 107.22 19.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.897 0.38 . . . . 0.0 111.36 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.1 m -66.55 130.7 32.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.719 179.873 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.546 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -74.27 58.58 0.73 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.069 0.461 . . . . 0.0 110.442 179.504 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.567 ' O ' ' N ' ' A' ' 11' ' ' TYR . 7.1 mt-10 26.2 -153.61 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.442 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -60.16 56.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.611 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.567 ' N ' ' O ' ' A' ' 9' ' ' GLU . 42.8 t80 -50.69 140.97 18.41 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.414 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' A' ' 11' ' ' TYR . 17.0 Cg_endo -57.29 92.48 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 -179.68 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.0 t -53.88 105.88 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.185 -179.622 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 p -176.33 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.05 179.98 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.571 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 16.2 mmmt -66.02 136.39 55.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.108 179.169 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.571 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.5 m -170.11 -64.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.616 0.246 . . . . 0.0 111.492 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.477 ' C ' ' O ' ' A' ' 16' ' ' CYS . 1.7 mm-40 -28.14 -38.8 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.408 -179.478 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 16' ' ' CYS . 1.1 mp -70.65 -120.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.19 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.45 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -179.65 -20.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.248 0.547 . . . . 0.0 111.631 -179.736 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.479 ' O ' ' C ' ' A' ' 21' ' ' GLN . 1.2 t-20 -47.62 -106.38 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.847 -178.93 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.479 ' C ' ' O ' ' A' ' 20' ' ' ASN . 13.7 mm-40 -25.26 -60.22 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.309 -179.131 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -54.04 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.937 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 2.5 t-20 -48.73 -54.83 13.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.901 -179.324 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -52.29 -55.83 18.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.648 179.907 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 96.8 m-20 -50.74 -55.16 17.99 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.262 -179.619 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.535 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.0 m -54.85 -45.9 74.61 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.938 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -61.44 11.84 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.531 -0.758 . . . . 0.0 112.223 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.535 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.7 tt -165.02 -47.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.294 -0.562 . . . . 0.0 112.261 -179.469 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 92.4 m-20 -66.7 -11.27 53.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.133 0.492 . . . . 0.0 110.169 179.789 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.427 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 36.0 mmtm -141.72 5.37 1.77 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.038 179.427 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.427 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 41.17 46.05 2.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.737 -179.866 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.32 -173.7 4.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.917 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.12 -23.59 18.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.291 0.567 . . . . 0.0 109.698 179.541 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -177.64 -168.44 0.18 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.993 179.702 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.468 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . 166.95 170.26 31.6 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.929 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -179.31 -179.97 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.732 0.301 . . . . 0.0 110.259 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 39.1 m -88.61 88.82 7.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.266 179.391 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -91.72 159.06 16.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.834 -179.734 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.565 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 5.0 m-85 -83.77 166.26 18.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.008 179.926 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 6.3 p-10 -129.19 -173.15 2.91 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.047 -179.532 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.52 2.06 0.19 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.29 -179.656 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.53 ' O ' ' CD ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -95.61 -63.89 1.11 Allowed 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.391 179.777 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.53 ' CD ' ' O ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 139.78 5.08 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.225 1.41 . . . . 0.0 109.734 179.397 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.565 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.4 OUTLIER -90.96 -140.63 0.16 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.882 0.372 . . . . 0.0 111.302 -179.518 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.53 ' CD2' ' CZ ' ' A' ' 39' ' ' TYR . 0.2 OUTLIER -147.32 149.16 32.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 -179.597 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.51 HE22 ' CG ' ' A' ' 40' ' ' ASP . 3.5 mp0 -148.83 136.78 20.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.674 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.424 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -66.18 87.19 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.768 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.7 mt -86.57 124.07 40.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.047 0.451 . . . . 0.0 111.627 -179.803 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.7 m -93.12 110.68 22.18 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.202 178.442 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.62 130.5 37.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.37 0.605 . . . . 0.0 112.084 -178.509 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -100.01 -42.04 6.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.24 179.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.169 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.296 -179.473 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.417 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.8 m . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 120.866 0.365 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 138.32 24.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.743 0.306 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -143.76 114.65 7.76 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.539 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.417 ' O ' ' CG2' ' A' ' 7' ' ' VAL . 2.7 m -66.53 127.82 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.047 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -85.19 80.09 9.33 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.312 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -57.29 -70.38 0.13 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.398 0.618 . . . . 0.0 110.042 -179.003 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.403 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 60.0 t-20 -51.92 86.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.707 178.964 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.618 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.7 t80 -177.8 97.34 0.22 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.452 -179.027 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.537 ' O ' ' C ' ' A' ' 13' ' ' VAL . 79.8 Cg_exo -45.94 75.65 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.814 2.342 . . . . 0.0 112.978 -179.574 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.618 ' N ' ' O ' ' A' ' 11' ' ' TYR . 15.9 t -7.86 -62.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 O-C-N 123.798 0.686 . . . . 0.0 112.52 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.518 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 67.4 p 27.23 -92.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.481 -179.82 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.518 ' N ' ' OG ' ' A' ' 14' ' ' SER . 0.1 OUTLIER -68.9 156.49 38.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.54 -179.624 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 1.7 m -172.59 -37.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.73 52.04 1.39 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.298 0.571 . . . . 0.0 109.785 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.4 mt -161.95 96.24 1.0 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.282 -179.215 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.18 78.74 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.737 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.566 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER -162.01 -79.14 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.292 179.847 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.51 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -22.75 -86.16 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.347 179.844 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.487 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 1.9 m -57.55 -52.38 65.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.163 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.84 -75.18 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.573 -179.103 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.566 ' N ' ' O ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -48.94 -57.13 6.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.724 -179.077 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.493 ' O ' ' N ' ' A' ' 29' ' ' ASP . 34.6 m-20 -52.11 -56.44 14.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.336 -179.453 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.567 ' C ' ' H ' ' A' ' 28' ' ' LEU . 94.9 m -50.44 -53.06 32.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.029 0.442 . . . . 0.0 110.064 179.834 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -61.99 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.335 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.567 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.4 tt -163.68 -40.82 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -179.759 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.493 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -67.2 -40.07 86.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.754 0.312 . . . . 0.0 110.764 -179.707 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.55 ' CB ' ' HH ' ' A' ' 51' ' ' TYR . 4.6 mtpp -112.72 15.49 19.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.544 179.486 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.7 m170 52.04 44.37 29.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.852 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.61 -154.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.896 0.379 . . . . 0.0 111.121 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.2 mtp85 -142.52 -2.99 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.831 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.3 p -175.32 -179.83 1.38 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.728 -179.94 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 156.73 167.95 18.68 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.337 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -178.51 174.99 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.903 0.382 . . . . 0.0 110.901 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -86.54 133.9 33.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.1 179.661 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -144.98 148.6 33.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.057 0.456 . . . . 0.0 111.44 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -75.44 -179.73 4.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.456 -179.531 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.546 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -154.85 -179.86 8.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.072 179.9 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.4 0.62 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.946 0.403 . . . . 0.0 110.462 -179.979 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.546 ' H ' ' C ' ' A' ' 40' ' ' ASP . 25.4 mtmm -102.2 -12.65 17.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.164 -179.886 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.477 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 15.7 ttp180 83.16 -5.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -95.6 156.13 16.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.435 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.8 mp -91.44 157.4 17.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.037 0.446 . . . . 0.0 111.775 -179.568 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -146.03 143.7 29.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.786 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.2 m -79.34 97.96 6.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.7 mt -87.06 126.09 40.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.9 m -98.84 111.75 24.05 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.955 179.421 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -95.22 131.64 41.05 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.55 ' HH ' ' CB ' ' A' ' 30' ' ' LYS . 35.1 m-85 -103.98 -37.01 7.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.862 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.417 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 1.4 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.706 -178.819 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 121.036 0.446 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 116.27 8.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.504 179.535 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.616 ' NZ ' ' HH ' ' A' ' 51' ' ' TYR . 11.2 pttm -152.46 135.99 16.04 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.253 -0.579 . . . . 0.0 112.1 -178.977 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.55 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -67.23 150.85 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.582 179.228 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.674 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -64.28 61.6 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.462 179.813 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 7' ' ' VAL . 2.8 mt-10 16.76 -140.65 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.38 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.78 12.52 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -178.202 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.623 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 67.3 t80 -50.98 143.11 16.14 Favored Pre-proline 0 N--CA 1.467 0.387 0 O-C-N 121.952 -0.468 . . . . 0.0 109.786 179.597 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.583 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 9.4 Cg_endo -48.16 -88.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.876 1.717 . . . . 0.0 112.179 -179.596 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.64 ' C ' ' H ' ' A' ' 15' ' ' LYS . 71.0 t 117.47 -8.12 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.638 1.175 . . . . 0.0 110.728 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 p -66.28 25.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.24 179.69 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.64 ' H ' ' C ' ' A' ' 13' ' ' VAL . 0.6 OUTLIER -172.02 99.57 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.96 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -171.25 27.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.815 -179.097 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.513 ' N ' ' CD ' ' A' ' 17' ' ' GLN . 1.7 mm100 -76.16 17.23 0.36 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.768 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.436 ' H ' ' C ' ' A' ' 16' ' ' CYS . 7.1 mt -163.42 -90.29 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.972 -179.848 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.92 -150.97 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.147 0.499 . . . . 0.0 110.995 -179.082 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.552 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.1 OUTLIER 67.0 -75.47 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.914 179.899 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.552 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 4.8 tp-100 -38.13 -83.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 -179.667 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.623 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -57.68 -40.74 80.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 110.737 179.416 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.411 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -56.66 -76.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.865 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.28 -40.38 24.67 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.845 179.946 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 29' ' ' ASP . 65.6 m-20 -55.04 -68.52 0.18 Allowed 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.055 -179.787 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.674 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -54.52 -39.33 67.51 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.793 179.824 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.413 ' HZ1' ' HA ' ' A' ' 24' ' ' TYR . 3.0 ttpm? -60.77 6.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.088 179.723 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.521 ' H ' ' C ' ' A' ' 26' ' ' CYS . 17.4 tp -163.38 -36.77 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.546 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 25' ' ' ASP . 11.5 m-20 -67.68 -13.34 62.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.068 0.461 . . . . 0.0 110.351 -179.918 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -141.31 8.85 2.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.074 179.398 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 56.8 50.69 12.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.959 179.925 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.85 173.8 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.764 179.83 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -93.39 -51.2 5.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.294 179.886 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.3 p -160.96 126.57 3.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 179.871 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.411 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . -132.15 167.57 22.86 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.878 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -176.76 161.18 2.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.358 0.599 . . . . 0.0 111.003 -179.885 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -86.94 128.32 35.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.764 -179.737 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -125.62 148.75 48.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.043 0.449 . . . . 0.0 111.109 -179.725 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.625 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 25.2 m-85 -99.26 152.6 19.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.131 179.444 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.48 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.3 OUTLIER -95.92 172.63 7.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.176 179.147 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -61.66 -2.02 0.71 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.035 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.48 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -97.59 -80.06 0.45 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.301 179.384 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.05 21.59 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.463 179.601 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.625 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -95.26 -165.1 1.24 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.767 0.318 . . . . 0.0 111.197 -179.964 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.406 ' CD1' ' CZ ' ' A' ' 39' ' ' TYR . 1.4 mt -146.22 147.06 31.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 0.0 111.057 -179.5 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -148.75 125.4 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 65.9 m -77.74 95.91 4.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.819 -179.92 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.3 mm -83.77 114.61 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.95 -179.428 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.5 m -106.04 111.84 24.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.317 178.984 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -96.82 153.85 17.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.064 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.616 ' HH ' ' NZ ' ' A' ' 6' ' ' LYS . 37.8 m-85 -121.06 -25.95 5.23 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.966 -178.889 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.465 0.281 0 CA-C-O 120.872 0.367 . . . . 0.0 111.245 -179.71 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.406 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.2 m . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 121.144 0.497 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 tptm -98.43 132.06 44.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.536 179.686 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -149.26 117.42 6.39 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.887 0.375 . . . . 0.0 111.516 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.4 143.41 15.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.16 -179.908 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.478 ' CE1' ' NZ ' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -86.34 109.42 18.98 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.025 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.505 ' O ' ' O ' ' A' ' 10' ' ' ASN . 2.5 mt-10 -55.1 -174.79 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.477 -178.916 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.505 ' O ' ' O ' ' A' ' 9' ' ' GLU . 5.5 p30 17.57 104.6 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.855 0.722 . . . . 0.0 111.923 -179.575 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.533 ' C ' ' H ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -179.86 81.57 0.19 Allowed Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.272 -179.636 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.496 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 52.7 Cg_exo -56.79 5.93 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 123.235 2.624 . . . . 0.0 113.822 -178.793 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.533 ' H ' ' C ' ' A' ' 11' ' ' TYR . 90.7 t 101.87 -72.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.201 1.001 . . . . 0.0 111.505 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.491 ' C ' ' O ' ' A' ' 13' ' ' VAL . 7.0 p 27.72 89.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 14' ' ' SER . 1.0 OUTLIER 92.86 -123.63 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.426 -179.426 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER 78.94 -49.18 0.43 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.528 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.88 -12.88 8.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.082 0.468 . . . . 0.0 110.659 -179.568 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.576 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 0.8 OUTLIER -71.82 -45.08 62.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.094 179.885 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.576 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 101.98 3.86 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 O-C-N 123.773 0.67 . . . . 0.0 110.802 -179.619 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.595 ' O ' ' N ' ' A' ' 22' ' ' CYS . 5.3 t-20 -97.03 -118.24 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.744 179.81 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 20' ' ' ASN . 14.7 mm100 -1.14 -65.31 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.952 0.782 . . . . 0.0 112.326 179.677 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.4 t -57.11 -69.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.93 179.887 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.41 ' N ' ' O ' ' A' ' 20' ' ' ASN . 25.0 t30 -50.45 -51.06 50.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.27 179.933 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.49 -47.31 76.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.64 179.367 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.429 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 97.3 m-20 -57.19 -55.3 36.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.871 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.641 ' C ' ' H ' ' A' ' 28' ' ' LEU . 57.0 m -56.06 -47.57 77.68 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.869 179.724 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.86 8.83 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.112 178.902 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.673 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -162.79 -132.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.677 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.416 ' H ' HD12 ' A' ' 28' ' ' LEU . 1.6 m-20 39.85 -77.2 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.461 0.476 . . . . 0.0 111.897 -179.889 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.673 ' N ' ' O ' ' A' ' 28' ' ' LEU . 12.6 mttp -91.99 -4.91 53.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.719 0.295 . . . . 0.0 110.981 -179.769 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.526 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.6 OUTLIER 82.99 44.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.642 179.391 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.508 ' CB ' ' O ' ' A' ' 26' ' ' CYS . . . -88.0 172.7 9.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.26 179.276 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -95.73 -29.25 14.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.009 0.433 . . . . 0.0 110.49 179.921 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.7 p -174.54 -164.67 0.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.653 179.882 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 168.54 -178.5 42.01 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.348 -179.909 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -178.22 160.7 1.38 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.868 0.366 . . . . 0.0 110.622 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 137.27 32.48 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.566 -179.81 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -146.39 131.78 18.61 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.147 0.499 . . . . 0.0 112.202 -179.405 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.535 ' CZ ' ' O ' ' A' ' 43' ' ' ARG . 1.2 m-85 -39.04 163.51 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.598 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 44' ' ' ASN . 19.5 p30 -136.87 -161.76 1.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.192 179.504 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -63.1 -28.33 70.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.146 -179.664 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 24.0 mmmt -99.67 28.17 4.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.186 -179.794 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.535 ' O ' ' CZ ' ' A' ' 39' ' ' TYR . 28.8 mtm180 59.74 5.8 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.433 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 73.2 m-80 -94.96 145.94 24.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.968 0.413 . . . . 0.0 111.215 -179.7 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.444 ' CD2' ' H ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -91.34 120.79 32.52 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -178.622 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -98.61 148.57 23.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.542 178.306 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -78.58 98.14 6.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.629 -179.383 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.4 mt -87.83 116.73 30.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.25 179.397 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.6 m -96.52 120.89 37.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 179.924 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -97.25 134.59 40.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.359 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -104.65 -28.43 11.23 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.667 -178.943 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.406 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 0.0 111.384 -179.495 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.432 0.158 . . . . 0.0 111.044 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.481 ' N ' ' CD ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -140.47 151.14 44.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.939 0.4 . . . . 0.0 111.8 -179.363 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -148.89 133.75 17.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.504 -179.771 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.8 m -65.66 139.75 20.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.649 179.778 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.474 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -81.51 54.33 2.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.859 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.609 ' O ' ' N ' ' A' ' 11' ' ' TYR . 13.1 mt-10 25.22 -145.59 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.784 -179.968 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -57.62 58.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.104 -179.51 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.609 ' N ' ' O ' ' A' ' 9' ' ' GLU . 35.4 t80 -56.19 121.33 41.16 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 110.513 -0.18 . . . . 0.0 110.513 179.424 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -41.02 90.12 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.547 1.498 . . . . 0.0 111.292 179.096 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.537 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -51.45 95.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.222 0.534 . . . . 0.0 111.11 -179.276 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 91.0 p -175.25 130.66 0.29 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.54 -179.903 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.498 ' O ' ' C ' ' A' ' 16' ' ' CYS . 26.8 mttt 87.96 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.764 0.665 . . . . 0.0 110.919 -179.537 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.498 ' C ' ' O ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER 25.2 98.01 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.344 0.403 . . . . 0.0 111.282 179.953 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.426 ' O ' ' C ' ' A' ' 18' ' ' LEU . 31.7 mt-30 -120.65 50.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 -179.981 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.573 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 26.1 mt 36.5 89.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.909 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 103.28 149.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 124.107 0.879 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.608 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.2 OUTLIER 84.46 -68.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 179.547 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.608 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 6.7 mm-40 -49.43 -79.06 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.672 0.272 . . . . 0.0 111.011 -179.542 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.1 m -55.23 -39.17 69.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.916 0.388 . . . . 0.0 110.52 179.956 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -55.65 -81.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.594 179.45 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.72 -46.8 30.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.232 -179.855 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.444 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 3.6 m-20 -51.82 -66.53 0.37 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.461 0.172 . . . . 0.0 110.93 -179.66 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.574 ' C ' ' H ' ' A' ' 28' ' ' LEU . 28.8 m -55.36 -36.54 66.44 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.384 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -60.48 6.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.17 179.297 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.574 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.5 tp -159.64 -34.16 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.288 -179.384 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 25' ' ' ASP . 36.0 m-20 -70.61 -56.82 5.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.004 0.43 . . . . 0.0 110.111 179.293 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 2.1 mptt -102.61 21.3 15.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.336 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.4 p80 35.43 45.17 0.21 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.154 0.502 . . . . 0.0 110.796 -179.943 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.09 -132.79 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.608 179.798 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -139.32 -31.12 0.7 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.294 179.382 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.2 p -167.33 -164.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.796 -179.931 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.09 -171.31 44.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -177.15 154.33 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.852 0.358 . . . . 0.0 110.983 -179.969 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 92.2 m -85.52 96.71 9.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.566 179.976 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -108.12 163.0 13.54 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.194 -179.872 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.506 ' O ' ' O ' ' A' ' 40' ' ' ASP . 27.5 m-85 -87.03 -22.77 25.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.769 179.745 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.529 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER 48.0 171.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.803 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.74 39.58 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.469 -179.681 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' A' ' 40' ' ' ASP . 16.2 mtmt -144.64 -1.76 0.88 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.563 -179.666 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 41.76 65.91 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.233 0.539 . . . . 0.0 109.934 -179.515 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -138.94 0.97 2.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.325 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 tm? 51.63 63.86 2.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.012 0.434 . . . . 0.0 110.377 179.218 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -95.03 169.86 9.82 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.418 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -96.69 114.58 26.23 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.404 -179.753 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 23.4 mt -90.6 132.09 36.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.542 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.9 m -100.95 112.86 25.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.753 179.482 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -94.09 151.94 19.13 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.726 179.829 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -124.0 -29.3 3.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.251 -178.783 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 35.1 m . . . . . 0 N--CA 1.463 0.193 0 CA-C-O 120.766 0.317 . . . . 0.0 111.143 -179.588 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 93.4 m . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.904 0.383 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.427 ' CD ' ' C ' ' A' ' 5' ' ' LYS . 2.5 tmtt? -145.94 131.46 18.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.13 114.26 5.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.07 -179.949 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -64.67 130.95 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.304 179.956 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.531 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -71.59 64.26 0.44 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.03 0.443 . . . . 0.0 110.344 179.781 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.531 ' O ' ' O ' ' A' ' 8' ' ' TYR . 3.4 mt-10 29.26 -156.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.147 179.366 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.44 47.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.386 -179.315 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.605 ' O ' ' O ' ' A' ' 12' ' ' PRO . 58.2 t80 -52.25 145.3 19.45 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.183 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.605 ' O ' ' O ' ' A' ' 11' ' ' TYR . 73.8 Cg_exo -49.58 -139.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.895 1.73 . . . . 0.0 112.597 179.863 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.621 ' C ' ' H ' ' A' ' 15' ' ' LYS . 0.5 OUTLIER -179.26 -19.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.743 179.852 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.3 p -64.24 19.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -179.906 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.621 ' H ' ' C ' ' A' ' 13' ' ' VAL . 1.7 tttm -173.89 104.76 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.925 0.393 . . . . 0.0 111.502 -179.909 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.84 110.89 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.072 179.424 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -127.46 -54.02 1.35 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.822 -179.649 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.567 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 0.4 OUTLIER -179.31 89.44 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.794 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.567 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 96.71 174.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.491 0.662 . . . . 0.0 112.62 178.219 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.89 -78.31 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.819 179.265 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -39.04 -85.03 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.581 -179.051 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.8 m -58.15 -40.39 81.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.701 -179.346 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -52.98 -70.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.529 -179.506 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.572 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.55 -54.61 25.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.705 0.288 . . . . 0.0 111.114 -179.551 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 29' ' ' ASP . 29.9 m-20 -49.57 -60.69 2.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.926 -179.514 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.508 ' C ' ' H ' ' A' ' 28' ' ' LEU . 37.9 m -54.98 -32.7 61.83 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.97 179.65 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.24 0.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.318 179.512 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.05 -37.12 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 -179.204 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -65.84 -16.87 64.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.767 0.318 . . . . 0.0 111.101 -179.314 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mmtt -142.6 5.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.967 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.8 36.9 19.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.767 179.897 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.38 -169.76 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.387 -179.744 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -97.85 -20.9 17.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.655 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p 171.31 -163.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.334 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.65 -175.22 46.28 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.589 179.901 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -175.81 158.48 2.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 0.0 110.407 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 3.8 m -87.52 130.53 34.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.49 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -149.21 165.84 30.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.776 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.611 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.3 m-85 -81.88 166.86 19.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.35 179.705 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -124.38 87.08 2.66 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.162 0.506 . . . . 0.0 111.035 179.956 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' A' ' 40' ' ' ASP . 59.1 mt-10 21.25 41.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.5 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.605 ' N ' ' O ' ' A' ' 40' ' ' ASP . 5.0 ttmm -147.13 -76.47 0.18 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.949 0.404 . . . . 0.0 110.979 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 162.71 58.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.558 -179.959 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.611 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 20.2 m-80 -141.01 -164.05 1.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.337 -179.684 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.3 tp -152.64 82.77 1.23 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.857 -179.656 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -92.33 165.63 12.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.21 -179.73 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.0 110.47 22.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.342 -179.696 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.9 mp -89.22 122.25 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.209 179.541 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -93.57 113.39 25.49 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.902 0.382 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -95.2 139.83 30.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.889 -179.819 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -106.95 -11.95 15.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.167 -179.62 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.5 m . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.263 -179.448 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.911 0.386 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.4 122.56 40.58 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.905 179.12 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -148.78 144.49 27.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 111.206 -179.064 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.509 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 21.7 m -62.24 162.25 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 CA-C-O 121.165 0.507 . . . . 0.0 111.068 179.52 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.539 ' C ' ' CD1' ' A' ' 8' ' ' TYR . 3.5 p90 -67.71 -29.56 68.84 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.799 -179.653 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.548 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER 26.81 101.87 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.538 -177.458 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.548 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 49.3 m-20 104.91 79.76 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.832 179.903 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.55 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.7 t80 170.42 96.47 0.04 OUTLIER Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.512 179.125 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.579 ' O ' ' N ' ' A' ' 14' ' ' SER . 96.1 Cg_exo -44.86 112.1 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.208 1.938 . . . . 0.0 112.399 -179.996 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.59 73.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.429 -179.838 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.579 ' N ' ' O ' ' A' ' 12' ' ' PRO . 9.2 p -63.79 -24.4 67.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.634 179.641 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -173.48 165.11 4.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.159 179.645 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -173.42 10.37 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -89.0 -33.44 17.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 0.0 110.719 179.863 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.58 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 3.3 mt -70.89 -58.61 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.547 -179.941 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.58 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 105.35 59.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.884 0.74 . . . . 0.0 110.974 -179.256 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.754 HD21 ' N ' ' A' ' 21' ' ' GLN . 0.5 OUTLIER -155.35 -51.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.702 179.695 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.754 ' N ' HD21 ' A' ' 20' ' ' ASN . 0.9 OUTLIER -47.93 -76.74 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.475 179.926 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.55 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -59.74 -42.38 93.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.734 0.302 . . . . 0.0 110.939 179.789 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.599 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 2.7 t-20 -54.7 -76.97 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.106 179.883 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.95 -37.81 21.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.346 179.832 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.598 ' O ' ' N ' ' A' ' 29' ' ' ASP . 68.0 m-20 -55.5 -69.58 0.13 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.655 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.556 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -51.66 -38.16 53.65 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.904 179.828 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.408 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 3.5 mtpt -57.93 3.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.117 179.368 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.556 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.01 -43.64 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.864 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.598 ' N ' ' O ' ' A' ' 25' ' ' ASP . 84.2 m-20 -68.17 -8.08 35.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.699 0.285 . . . . 0.0 111.301 -179.429 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -140.29 13.32 2.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.779 179.925 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 22.0 m170 59.94 38.17 21.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.977 179.321 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.49 -166.13 1.52 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.649 179.181 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.408 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 46.7 ttt180 -129.54 -48.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.972 0.415 . . . . 0.0 110.448 179.558 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.447 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 1.1 p -158.53 124.39 4.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.268 179.531 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.599 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . -130.18 -176.53 14.46 Favored Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.38 -0.914 . . . . 0.0 113.649 -179.234 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -174.93 158.77 2.59 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.537 0.208 . . . . 0.0 110.776 179.929 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 139.03 30.93 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.606 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -149.29 154.34 38.87 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -163.52 172.58 14.22 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.902 -179.43 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.568 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -139.4 -160.65 1.09 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.818 0.342 . . . . 0.0 111.241 -178.964 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.473 ' O ' ' CG ' ' A' ' 41' ' ' GLU . 38.5 tt0 -60.05 3.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.115 -179.417 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.576 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.3 OUTLIER -94.18 4.65 53.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.233 0.539 . . . . 0.0 109.925 179.48 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 46.33 10.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.015 -179.8 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.576 ' H ' ' C ' ' A' ' 42' ' ' LYS . 10.5 m120 -94.68 97.19 9.91 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.143 0.497 . . . . 0.0 110.274 179.462 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.4 tp -89.47 130.31 35.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.677 -178.942 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -137.28 154.57 50.08 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.152 -179.009 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -92.94 111.78 23.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.33 179.834 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.5 mm -80.46 109.94 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.365 179.059 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 m -96.87 115.35 27.27 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.47 0.481 . . . . 0.0 110.721 -179.444 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' A' ' 34' ' ' SER . 1.0 OUTLIER -95.24 131.83 40.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.176 -179.67 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -101.9 -17.4 16.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.178 -179.42 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.489 -179.977 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.458 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.5 m . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.543 0.211 . . . . 0.0 110.938 . . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.7 137.77 32.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.481 -179.606 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -149.22 123.01 9.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.497 179.681 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.15 142.63 16.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -81.26 103.16 10.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.435 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.54 ' O ' ' C ' ' A' ' 10' ' ' ASN . 15.4 mm-40 -59.54 168.28 1.67 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.399 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.54 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 11.42 108.21 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.849 0.718 . . . . 0.0 111.883 -179.567 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -177.97 143.48 0.48 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.698 -179.789 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.414 ' C ' ' O ' ' A' ' 11' ' ' TYR . 33.0 Cg_exo -28.98 83.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.179 2.586 . . . . 0.0 113.316 -179.686 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.571 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -58.26 -39.48 73.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.148 179.468 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.23 -39.25 94.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.208 -179.763 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 91.29 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.914 0.388 . . . . 0.0 110.868 -179.908 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -172.86 111.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.392 -179.689 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -149.13 -22.4 0.3 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.504 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.486 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -166.22 176.73 7.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.212 0.529 . . . . 0.0 111.518 -179.27 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.475 ' C ' ' OD1' ' A' ' 20' ' ' ASN . . . -58.71 103.45 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.85 -179.999 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.547 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.6 p-10 176.24 -88.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.973 178.982 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.761 ' N ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -27.57 -85.63 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.418 -0.113 . . . . 0.0 111.231 -179.84 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.601 ' H ' ' NE2' ' A' ' 21' ' ' GLN . 0.8 OUTLIER -52.33 -56.58 13.9 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.6 0.238 . . . . 0.0 111.269 -179.77 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.498 HD21 ' N ' ' A' ' 35' ' ' GLY . 3.9 t-20 -49.05 -74.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.102 0.477 . . . . 0.0 110.49 179.968 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.547 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -49.84 -42.49 47.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.399 179.685 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 29' ' ' ASP . 69.1 m-20 -55.19 -66.47 0.4 Allowed 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.649 -179.688 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 1.8 m -52.69 -39.68 62.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.26 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tptm -57.16 2.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.151 179.849 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.539 ' H ' ' C ' ' A' ' 26' ' ' CYS . 64.0 tp -163.78 -37.56 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -66.81 -51.62 53.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.891 0.377 . . . . 0.0 110.505 179.926 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.519 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -106.12 6.48 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.306 179.8 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.519 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 47.12 49.28 15.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.703 -179.859 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.55 -127.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.444 179.37 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.25 -42.89 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.993 0.425 . . . . 0.0 110.623 179.924 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -158.43 -163.51 1.29 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.32 179.964 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.498 ' N ' HD21 ' A' ' 23' ' ' ASN . . . 167.14 174.69 36.53 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.525 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -175.57 168.73 3.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.778 0.323 . . . . 0.0 110.561 -179.951 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.5 m -88.06 147.49 24.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.277 -179.469 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -146.93 131.41 17.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.606 179.812 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.617 ' CD1' ' O ' ' A' ' 44' ' ' ASN . 21.1 m-85 -74.14 -172.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.399 -179.444 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.502 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 0.8 OUTLIER -163.47 -171.48 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.882 -179.932 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.13 -20.0 63.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.261 -179.638 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 43' ' ' ARG . 19.7 mmtt -99.43 29.11 4.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.046 179.871 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LYS . 11.9 ttt180 35.76 34.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.83 -179.957 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.617 ' O ' ' CD1' ' A' ' 39' ' ' TYR . 2.5 m-20 -94.6 -162.84 0.98 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 -179.949 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.0 mt -146.22 100.06 3.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 110.991 -179.58 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -92.96 149.69 21.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 179.842 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.51 110.31 22.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.116 -179.552 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.407 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 9.6 mm -87.95 128.26 40.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 179.984 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 61.1 m -108.39 116.65 32.36 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 179.513 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.82 133.39 38.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.915 0.388 . . . . 0.0 110.116 179.324 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -100.66 -33.8 10.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.2 -178.751 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.458 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.654 -179.8 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.531 0.228 0 CA-C-O 121.298 0.571 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.483 ' NZ ' ' OD2' ' A' ' 50' ' ' ASP . 10.7 mmmt -143.97 92.96 2.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.71 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -96.3 127.46 42.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.691 0.281 . . . . 0.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.2 m -66.03 133.65 30.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 112.091 -179.787 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.483 ' O ' ' O ' ' A' ' 9' ' ' GLU . 13.5 t80 -77.09 93.84 3.94 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.688 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' O ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -47.96 -179.21 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.303 -177.922 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.579 ' O ' ' O ' ' A' ' 9' ' ' GLU . 43.5 m-20 16.34 109.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.675 0.609 . . . . 0.0 111.987 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.674 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 12.8 t80 -173.07 144.52 1.18 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.144 -179.071 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.62 ' O ' ' O ' ' A' ' 11' ' ' TYR . 81.2 Cg_exo -43.56 -134.86 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 123.108 2.539 . . . . 0.0 113.831 -179.378 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.564 ' O ' ' N ' ' A' ' 15' ' ' LYS . 2.2 t -177.46 -56.52 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.879 -179.031 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.8 p -60.08 66.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.865 -178.729 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.697 ' O ' ' N ' ' A' ' 17' ' ' GLN . 4.5 mttm -174.47 -68.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.29 179.201 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.7 ' O ' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER 13.04 -66.5 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 178.94 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.697 ' N ' ' O ' ' A' ' 15' ' ' LYS . 23.4 mt-30 -54.65 51.52 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.638 0.586 . . . . 0.0 111.842 -178.744 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.7 ' N ' ' O ' ' A' ' 16' ' ' CYS . 11.7 mt -165.45 98.79 0.7 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.606 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.51 86.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.849 -179.424 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.617 ' C ' ' H ' ' A' ' 22' ' ' CYS . 3.7 t-20 -173.51 -78.12 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.816 -179.757 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.607 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER -60.46 41.4 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.521 -179.921 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 15.6 m -170.23 -59.01 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.147 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 27' ' ' LYS . 1.0 OUTLIER -56.69 -54.54 45.03 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.576 178.112 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.544 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.92 -47.91 76.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.028 178.957 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.631 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.0 m-20 -58.09 -68.75 0.22 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.409 -179.983 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.537 ' C ' ' H ' ' A' ' 28' ' ' LEU . 56.2 m -51.87 -41.46 61.89 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.023 -179.94 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.455 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 17.0 tttp -59.83 6.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.08 179.776 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.2 tp -164.68 -41.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.532 -0.467 . . . . 0.0 112.121 -179.396 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.631 ' N ' ' O ' ' A' ' 25' ' ' ASP . 55.4 m-20 -69.27 -12.98 62.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.29 -179.746 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.548 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 1.1 mptm? -138.19 6.05 2.56 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.831 0.348 . . . . 0.0 110.639 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.548 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 52.38 35.52 17.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.231 0.539 . . . . 0.0 110.447 -179.818 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.53 -167.22 1.76 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.649 179.702 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.01 -31.04 13.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.11 0.481 . . . . 0.0 109.856 179.63 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -171.93 -175.16 1.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.836 179.719 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.409 ' N ' ' HA ' ' A' ' 23' ' ' ASN . . . -152.11 95.23 0.15 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 119.965 -1.112 . . . . 0.0 113.519 -179.733 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.629 ' CG ' ' H ' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -74.76 -159.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.369 0.604 . . . . 0.0 111.894 179.775 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -153.25 137.69 16.73 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.305 179.559 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -150.71 158.91 44.71 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -178.538 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.764 ' CG ' ' N ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -169.75 -153.71 0.11 Allowed 'General case' 0 C--N 1.343 0.318 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.228 179.548 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.764 ' N ' ' CG ' ' A' ' 39' ' ' TYR . 0.2 OUTLIER 175.12 95.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.63 0.252 . . . . 0.0 111.131 179.333 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.411 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 8.5 mt-10 87.11 -70.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.704 179.565 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.677 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -150.38 29.23 0.71 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -179.665 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.664 ' C ' ' H ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -65.11 16.19 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.954 -179.328 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.677 ' H ' ' C ' ' A' ' 42' ' ' LYS . 30.4 m120 63.15 -15.82 0.06 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.261 -179.919 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.664 ' H ' ' C ' ' A' ' 43' ' ' ARG . 4.3 tp 59.5 133.43 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.904 177.873 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.428 ' OE1' ' C ' ' A' ' 45' ' ' LEU . 1.8 mp0 -141.34 165.05 28.59 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.555 0.693 . . . . 0.0 112.571 -178.514 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.674 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 63.0 m -80.65 110.15 15.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.037 -179.965 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.423 ' O ' ' N ' ' A' ' 36' ' ' GLU . 1.4 mp -93.6 126.23 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.888 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 98.5 m -88.98 117.23 27.84 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.439 179.688 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.483 ' OD2' ' NZ ' ' A' ' 5' ' ' LYS . 6.8 t70 -93.48 121.13 34.57 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.386 179.481 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -100.38 -17.36 17.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.931 -179.121 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.7 m . . . . . 0 C--N 1.33 -0.265 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.142 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.162 0 CA-C-O 120.704 0.288 . . . . 0.0 111.481 . . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -90.86 133.63 35.08 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.196 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.79 122.56 10.57 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.087 178.786 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.0 m -60.87 145.33 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 0.0 111.561 -179.695 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.523 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -87.64 60.35 5.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.001 179.418 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.577 ' C ' ' H ' ' A' ' 11' ' ' TYR . 35.5 mt-10 30.57 -158.61 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.021 179.707 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.422 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 14.7 p30 -58.48 34.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.649 -179.149 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.677 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 5.5 t80 -50.92 135.16 28.22 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.486 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.447 ' C ' ' O ' ' A' ' 11' ' ' TYR . 39.9 Cg_exo -30.95 84.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.329 2.02 . . . . 0.0 112.318 179.512 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.605 ' N ' ' O ' ' A' ' 11' ' ' TYR . 42.9 t -55.77 -15.64 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.956 -179.536 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.4 p -62.16 -93.71 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.8 -179.196 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.405 ' HZ1' ' HB3' ' A' ' 15' ' ' LYS . 2.3 mtpm? -67.82 153.25 44.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.331 0.586 . . . . 0.0 112.35 -178.793 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -174.52 -67.99 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.471 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.413 ' O ' ' C ' ' A' ' 18' ' ' LEU . 6.0 mm100 56.37 28.17 13.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.016 0.436 . . . . 0.0 111.065 179.59 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.413 ' C ' ' O ' ' A' ' 17' ' ' GLN . 40.4 mt 35.59 75.9 0.05 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.22 179.542 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -178.56 -147.94 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.343 179.719 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.548 ' O ' ' C ' ' A' ' 21' ' ' GLN . 3.0 t-20 -21.14 -107.96 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.453 -179.377 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.548 ' C ' ' O ' ' A' ' 20' ' ' ASN . 4.6 mm100 -5.81 -73.88 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.245 -179.575 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.6 t -57.5 -68.61 0.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.478 179.923 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -48.38 -59.5 3.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 -179.69 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.422 179.583 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.636 ' O ' ' N ' ' A' ' 29' ' ' ASP . 22.4 m-20 -50.93 -60.53 2.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.29 179.751 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.531 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.2 m -53.1 -53.98 42.3 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.714 179.278 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 14.27 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.672 -179.832 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.531 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.8 tm? -165.02 -52.19 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 119.876 -0.729 . . . . 0.0 112.613 -179.483 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.636 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -66.05 -15.72 63.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.574 0.226 . . . . 0.0 111.094 -179.06 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -134.31 13.16 3.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.733 0.301 . . . . 0.0 110.834 -179.973 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.4 m80 46.29 36.46 3.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.947 -179.955 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.4 -172.93 4.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.76 179.892 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -95.96 -45.31 6.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.889 179.959 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.411 ' OG ' ' OD1' ' A' ' 50' ' ' ASP . 38.3 p -177.55 154.74 1.01 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.534 179.833 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.63 -164.87 16.34 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.125 -1.036 . . . . 0.0 113.254 -179.684 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -177.19 175.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.699 0.285 . . . . 0.0 110.448 -179.864 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.412 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 0.0 OUTLIER -88.19 149.49 23.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.135 0.493 . . . . 0.0 111.918 -179.834 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' A' ' 37' ' ' CYS . 26.5 m-85 -148.91 145.68 27.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.168 179.388 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.501 ' O ' ' O ' ' A' ' 44' ' ' ASN . 17.0 m-85 -73.79 -102.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -179.522 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.463 ' CG ' ' O ' ' A' ' 39' ' ' TYR . 0.6 OUTLIER 48.97 -167.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.264 0.554 . . . . 0.0 111.086 -179.788 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER 27.64 63.17 0.1 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.307 -178.85 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.513 ' O ' ' N ' ' A' ' 44' ' ' ASN . 5.5 ttpt 69.68 65.95 0.25 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 178.655 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.45 ' C ' ' O ' ' A' ' 42' ' ' LYS . 8.7 mmt85 32.76 33.51 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.558 178.986 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.513 ' N ' ' O ' ' A' ' 42' ' ' LYS . 10.5 m-20 -95.64 129.93 42.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 178.891 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.08 86.38 7.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.13 0.49 . . . . 0.0 110.988 -179.574 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -89.64 158.46 17.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.658 179.832 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.677 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -99.67 108.94 21.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.641 -179.506 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.2 mt -85.83 110.22 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.076 179.498 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.2 m -97.34 121.96 39.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.538 179.438 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.477 ' OD2' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -98.91 134.86 41.17 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.516 0.674 . . . . 0.0 110.859 179.791 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -121.0 66.41 0.86 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.28 -178.917 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.477 ' SG ' ' OD2' ' A' ' 50' ' ' ASP . 77.8 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.777 0.322 . . . . 0.0 111.457 -179.709 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.136 0 CA-C-O 120.666 0.27 . . . . 0.0 110.283 . . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.592 ' H ' ' CD ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -97.87 145.37 26.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.069 0.462 . . . . 0.0 111.039 179.904 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -153.95 110.3 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.763 179.864 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -61.31 137.06 24.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.9 0.381 . . . . 0.0 111.656 -179.869 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.514 ' O ' ' C ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -64.51 66.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.598 179.056 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 7' ' ' VAL . 12.6 mp0 17.21 -115.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.415 178.99 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.667 HD21 ' N ' ' A' ' 10' ' ' ASN . 1.3 m120 -50.34 -72.22 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.784 -179.816 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.663 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 2.4 t80 10.89 79.24 0.06 OUTLIER Pre-proline 0 N--CA 1.466 0.365 0 O-C-N 123.791 0.682 . . . . 0.0 112.147 -178.836 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -46.54 -53.35 6.16 Favored 'Trans proline' 0 CA--C 1.518 -0.304 0 C-N-CA 122.877 2.385 . . . . 0.0 112.524 -179.675 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.49 ' O ' ' C ' ' A' ' 14' ' ' SER . 1.2 t 173.58 -50.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.52 179.615 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.551 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 5.5 p 23.05 55.23 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.875 -179.812 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.551 ' CB ' ' O ' ' A' ' 14' ' ' SER . 28.1 tptt 92.86 141.0 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.489 179.559 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.1 m -174.35 21.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.959 179.795 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.473 ' C ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER -101.03 44.65 1.0 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.342 0.592 . . . . 0.0 110.702 -179.783 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.9 mt -158.84 -129.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.449 179.744 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.43 46.66 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.531 -179.653 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.659 ' ND2' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -141.33 -47.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.611 179.795 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.659 ' N ' ' ND2' ' A' ' 20' ' ' ASN . 5.7 tp60 -47.96 -80.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.835 179.904 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.663 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 22.5 m -62.48 -33.67 75.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.385 -179.902 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -53.46 -65.79 0.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.014 0.435 . . . . 0.0 109.87 179.29 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.569 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.05 -38.58 68.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.071 178.968 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 29' ' ' ASP . 25.2 m-20 -52.45 -63.45 1.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.397 179.622 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.471 ' C ' ' H ' ' A' ' 28' ' ' LEU . 36.8 m -55.27 -39.31 69.68 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.08 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -59.37 3.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.586 -179.6 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.471 ' H ' ' C ' ' A' ' 26' ' ' CYS . 36.1 tp -165.93 -33.2 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.582 ' N ' ' O ' ' A' ' 25' ' ' ASP . 4.7 m-20 -65.83 -16.7 64.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.893 0.378 . . . . 0.0 110.487 -179.656 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.1 mtpm? -144.57 0.29 0.99 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.032 179.801 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m80 62.39 39.08 12.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.455 179.719 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.493 ' CB ' ' CE2' ' A' ' 51' ' ' TYR . . . -86.81 -171.02 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.676 179.538 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.28 -39.0 13.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.768 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.479 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.3 p -175.85 -147.33 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.294 179.666 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.479 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 149.24 173.48 19.9 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.555 -0.831 . . . . 0.0 113.36 179.952 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.45 ' CD ' ' O ' ' A' ' 35' ' ' GLY . 1.3 pm0 -175.11 172.41 2.81 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.683 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 145.64 25.61 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.663 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -145.15 149.34 34.82 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.35 179.551 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -80.54 150.44 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 111.355 -179.637 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 43' ' ' ARG . 24.8 p30 -99.12 -178.17 3.85 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.144 -179.863 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -63.01 -12.15 24.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.509 -179.477 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -94.92 -77.28 0.47 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.233 179.526 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.402 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 3.1 ptp180 175.45 1.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.329 -0.851 . . . . 0.0 112.161 179.482 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.502 ' N ' HD21 ' A' ' 44' ' ' ASN . 1.4 m-80 -93.97 151.64 19.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 111.316 -179.366 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.471 ' N ' ' CD1' ' A' ' 45' ' ' LEU . 2.9 mp -91.02 153.9 19.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.201 -179.707 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -144.52 132.7 21.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.278 179.689 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 83.8 m -81.35 105.58 12.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 112.073 -179.005 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.1 mt -88.47 120.73 37.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.188 179.43 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.2 m -92.67 119.38 32.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.402 178.889 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -86.63 144.93 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.514 -179.303 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.563 ' N ' ' O ' ' A' ' 4' ' ' CYS . 83.6 m-85 -138.84 42.15 2.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.36 -178.793 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 71.0 m . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.666 -178.869 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.463 0.215 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -142.58 103.61 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.65 0.262 . . . . 0.0 110.465 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -142.05 131.67 24.01 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.219 0.533 . . . . 0.0 111.635 -179.502 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.452 ' C ' ' H ' ' A' ' 9' ' ' GLU . 2.4 m -66.57 153.19 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.107 178.745 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.585 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.4 OUTLIER -81.81 36.3 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.086 0.47 . . . . 0.0 110.154 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.503 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.3 pt-20 10.86 -100.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.946 179.066 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 11' ' ' TYR . 2.7 m120 -43.22 -72.45 0.06 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.501 -178.767 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.529 ' C ' ' O ' ' A' ' 10' ' ' ASN . 33.5 t80 16.57 102.12 0.02 OUTLIER Pre-proline 0 N--CA 1.469 0.508 0 O-C-N 123.471 0.482 . . . . 0.0 111.819 -178.93 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -42.6 93.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.319 2.012 . . . . 0.0 112.936 -179.568 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.9 t -56.2 96.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.9 p -178.57 23.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.119 179.633 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -174.45 107.71 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.378 -179.987 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -170.25 -10.58 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.156 -179.373 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -62.57 19.69 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.757 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.645 ' H ' ' C ' ' A' ' 16' ' ' CYS . 14.0 mt -164.73 134.32 3.73 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.741 0.305 . . . . 0.0 110.324 179.954 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.428 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.16 -176.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 0.0 111.265 179.652 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.4 OUTLIER 81.9 -78.34 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.753 -179.828 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.49 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -29.15 -83.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.079 179.982 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.39 -46.07 91.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.061 0.458 . . . . 0.0 110.926 179.548 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.82 -75.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.22 -179.634 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.516 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -47.43 -47.19 26.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.869 -179.947 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.583 ' O ' ' N ' ' A' ' 29' ' ' ASP . 88.7 m-20 -52.12 -73.64 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.575 -179.248 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -51.59 -38.29 53.82 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.913 -179.833 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.405 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 64.9 tttt -63.15 7.18 0.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.964 179.392 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.51 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.8 tt -161.96 -22.29 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.859 -179.529 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -69.32 -55.59 10.01 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.025 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -101.17 3.44 41.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.134 179.312 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.9 m80 70.66 45.29 0.59 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.665 -179.547 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.49 -143.95 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.32 -179.717 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 50' ' ' ASP . 0.6 OUTLIER -142.54 -31.68 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.136 179.977 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 p -157.52 117.69 3.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.819 0.343 . . . . 0.0 111.876 -179.635 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -104.6 71.86 0.25 Allowed Glycine 0 C--N 1.337 0.584 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.596 179.731 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -73.25 179.5 3.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.116 0.484 . . . . 0.0 111.816 -179.998 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -148.17 142.51 26.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.941 179.587 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -148.7 143.41 26.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -178.769 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.479 ' C ' ' CD1' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -169.71 159.01 7.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.195 -1.366 . . . . 0.0 109.841 179.034 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -96.62 -82.51 0.4 Allowed 'General case' 0 CA--C 1.502 -0.87 0 CA-C-O 121.214 0.53 . . . . 0.0 111.91 -178.966 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.487 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -165.48 8.26 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.515 -179.657 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.414 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -98.12 2.93 49.1 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.768 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.414 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER 80.69 21.13 0.45 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.201 179.917 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -94.14 74.46 4.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-O 121.604 0.716 . . . . 0.0 109.845 179.001 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.2 tp -97.81 139.1 34.18 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.517 -1.22 . . . . 0.0 112.6 -178.09 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -141.85 144.89 34.1 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.022 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -97.38 110.1 22.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.808 -179.835 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -87.71 112.21 23.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 179.774 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.2 m -105.85 104.37 14.07 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.291 179.929 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 33' ' ' ARG . 4.3 t70 -96.16 136.18 36.97 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.008 179.275 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -101.84 -24.45 14.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.7 -178.548 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.136 179.803 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.941 0.401 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -97.07 146.16 25.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.487 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 mtpm? -150.33 121.34 7.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.994 0.426 . . . . 0.0 111.376 -179.942 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -66.04 151.3 10.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.902 179.407 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.555 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.6 OUTLIER -83.88 81.88 8.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.687 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 17.0 pt-20 -61.61 72.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.616 -179.495 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.579 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 31.4 t30 127.04 101.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.511 1.132 . . . . 0.0 110.527 -179.871 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -179.3 134.15 0.28 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.55 ' C ' ' H ' ' A' ' 14' ' ' SER . 89.0 Cg_endo -79.58 122.54 5.05 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.171 1.914 . . . . 0.0 112.553 -179.972 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.6 t -61.16 43.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.243 179.606 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.598 ' C ' ' H ' ' A' ' 16' ' ' CYS . 10.1 p -62.6 -110.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.952 0.406 . . . . 0.0 111.434 -179.502 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -67.59 23.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.41 -179.633 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -66.04 -26.06 67.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.751 179.736 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -67.38 12.67 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.973 -179.806 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.579 ' H ' ' C ' ' A' ' 16' ' ' CYS . 16.8 mt -162.89 124.34 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.426 -179.862 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.04 107.37 0.35 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.481 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.4 OUTLIER -174.56 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.267 179.998 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -46.13 -64.66 0.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.355 -179.652 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 t -56.11 -53.52 56.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.274 -179.545 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -51.68 -72.59 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.931 -179.845 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.81 -44.57 28.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.437 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 7.2 m-20 -55.51 -74.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.498 -179.542 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.514 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -52.17 -34.09 43.49 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.164 -179.658 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.21 1.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.263 179.34 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.514 ' H ' ' C ' ' A' ' 26' ' ' CYS . 57.9 tp -162.92 -29.82 0.04 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.991 -179.728 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.06 -48.58 57.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.765 0.317 . . . . 0.0 110.692 179.846 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -100.2 18.03 19.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.938 -179.918 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.1 m170 55.43 44.74 26.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 -179.727 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.4 -160.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.493 -179.732 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.507 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 40.4 ttm-85 -139.01 -27.3 0.82 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 -179.856 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 1.5 p -178.64 120.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.126 179.712 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -118.91 179.37 16.79 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.363 -179.271 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -178.71 145.71 0.31 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.65 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.93 131.37 34.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.833 0.349 . . . . 0.0 111.181 -179.675 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -146.7 171.35 15.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.303 -179.653 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -86.13 134.53 33.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.225 179.318 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 42' ' ' LYS . 2.4 p-10 -142.07 -83.23 0.19 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.19 0.519 . . . . 0.0 112.165 -179.101 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.576 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.1 OUTLIER -59.72 70.47 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.221 -178.095 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.4 mptt 53.81 85.07 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.536 179.252 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.609 ' HE ' ' N ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER 57.92 18.49 5.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.756 179.109 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.576 ' ND2' ' O ' ' A' ' 41' ' ' GLU . 1.9 m-80 -93.8 115.75 28.18 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 179.327 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.75 93.07 7.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.407 -179.026 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -100.94 -178.92 3.9 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.39 179.87 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -104.79 104.07 13.79 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.491 -179.568 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.615 ' N ' ' CD1' ' A' ' 48' ' ' ILE . 1.0 OUTLIER -88.65 109.53 20.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.511 179.305 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.0 m -96.95 119.18 34.94 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.774 0.321 . . . . 0.0 111.267 -179.709 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.503 ' CB ' ' O ' ' A' ' 34' ' ' SER . 2.2 t0 -94.48 137.08 34.05 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.185 0.517 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.507 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 5.6 m-85 -103.61 -17.89 14.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.46 179.996 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.0 m . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.972 -179.59 . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.126 0 CA-C-O 120.855 0.36 . . . . 0.0 110.558 . . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.41 ' O ' ' CE ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -147.08 145.55 29.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.998 179.972 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.466 ' HZ2' ' CD ' ' A' ' 9' ' ' GLU . 8.3 tttp -146.73 116.86 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.128 0.49 . . . . 0.0 110.861 -179.777 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -63.25 142.75 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.456 -179.573 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.602 ' C ' ' H ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -62.78 110.95 1.91 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.833 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.466 ' CD ' ' HZ2' ' A' ' 6' ' ' LYS . 26.7 mt-10 -60.65 5.86 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.398 -178.674 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.602 ' H ' ' C ' ' A' ' 8' ' ' TYR . 1.8 p-10 172.2 122.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.8 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.627 ' O ' ' N ' ' A' ' 13' ' ' VAL . 19.8 t80 -179.72 123.54 0.23 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.089 179.955 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.14 76.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.397 2.065 . . . . 0.0 113.138 -179.634 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.627 ' N ' ' O ' ' A' ' 11' ' ' TYR . 1.4 p -58.68 97.15 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.144 0.497 . . . . 0.0 110.981 179.849 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.562 ' C ' ' H ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -178.0 -57.78 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.778 -179.867 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.571 ' C ' ' H ' ' A' ' 17' ' ' GLN . 13.7 tttp -67.21 10.25 0.17 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.666 179.987 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.562 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -67.61 19.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.233 -179.921 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.571 ' H ' ' C ' ' A' ' 15' ' ' LYS . 0.4 OUTLIER -88.33 56.32 3.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 110.875 -179.682 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.5 mp -161.92 -122.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.671 179.737 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 174.01 28.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 -179.688 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 21' ' ' GLN . 29.1 t-20 -131.19 -52.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.486 179.961 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.446 ' HB3' ' HH ' ' A' ' 11' ' ' TYR . 8.2 mm-40 -37.19 -86.87 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.916 -179.764 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.8 m -59.87 -37.33 79.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.536 0.208 . . . . 0.0 111.326 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.485 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 13.5 t-20 -56.28 -75.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.68 0.276 . . . . 0.0 110.954 179.788 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.512 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -48.86 -43.57 38.93 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.906 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.598 ' O ' ' N ' ' A' ' 29' ' ' ASP . 10.7 m-20 -51.89 -57.36 9.61 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.684 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.424 ' C ' ' H ' ' A' ' 28' ' ' LEU . 96.3 m -53.62 -44.55 69.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.406 0.622 . . . . 0.0 109.464 178.801 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -62.51 7.51 0.07 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 113.165 -178.78 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.424 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -167.87 -37.65 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.933 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.598 ' N ' ' O ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -66.79 -12.55 59.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.769 0.319 . . . . 0.0 111.081 -179.259 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -144.63 10.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.082 179.768 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.7 m80 54.9 46.8 23.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.555 -179.883 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.6 -174.19 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.382 -179.664 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.401 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 0.9 OUTLIER -96.66 -59.63 1.77 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.229 179.586 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.449 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 3.9 p -158.05 114.05 2.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.694 179.991 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.485 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -105.62 164.26 13.99 Favored Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.142 -179.618 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -176.43 167.66 2.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.982 0.42 . . . . 0.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.4 m -89.29 130.01 35.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.278 -179.716 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -148.22 161.98 40.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.955 179.898 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.58 ' O ' ' N ' ' A' ' 41' ' ' GLU . 75.4 m-85 -91.2 115.28 27.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.816 179.799 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 6.8 p-10 -57.11 77.12 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.51 0.671 . . . . 0.0 110.492 179.854 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 39' ' ' TYR . 34.4 mt-10 27.87 40.57 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.688 -1.142 . . . . 0.0 112.177 -179.724 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -142.23 -81.83 0.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.099 178.807 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 10.1 mtp180 160.74 23.73 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.97 179.789 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.474 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 98.9 m-20 -97.65 -13.61 21.42 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.591 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.447 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 5.9 tp 57.68 122.19 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.644 0.259 . . . . 0.0 111.15 -179.665 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.474 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -149.54 -179.14 6.86 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.423 179.107 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.524 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 36.3 m -102.07 139.14 38.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 14.5 mt -139.4 121.21 16.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 0.0 112.052 -178.884 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 m -92.63 124.11 36.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.018 178.468 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' A' ' 34' ' ' SER . 9.0 t70 -88.49 124.38 33.93 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.126 0.489 . . . . 0.0 111.192 -179.319 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -115.18 50.2 1.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.311 -179.383 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 69.4 m . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.542 179.916 . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.815 0.34 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 135.5 26.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.436 179.924 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -149.79 121.87 8.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.913 0.387 . . . . 0.0 111.285 179.829 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -61.85 161.98 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.179 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.233 179.782 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -113.15 84.49 2.01 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.473 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.598 ' CD ' ' H ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -57.94 -79.62 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.146 -178.174 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.598 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 6.9 t-20 -38.96 -38.88 0.48 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.696 -178.416 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.443 ' HH ' ' HB3' ' A' ' 21' ' ' GLN . 53.0 t80 -52.87 124.84 37.56 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.585 -178.939 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.602 ' C ' ' H ' ' A' ' 14' ' ' SER . 73.0 Cg_exo -46.35 112.32 0.45 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 122.148 1.898 . . . . 0.0 112.579 179.567 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.3 p -60.59 7.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.477 179.598 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.602 ' H ' ' C ' ' A' ' 12' ' ' PRO . 5.1 p -60.66 -108.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.558 -179.252 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 ttpm? -63.44 149.74 45.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 -179.527 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -171.94 3.92 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.608 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.519 ' CA ' HE21 ' A' ' 17' ' ' GLN . 0.1 OUTLIER -86.62 -32.24 20.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.978 -179.892 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.602 ' C ' ' H ' ' A' ' 20' ' ' ASN . 1.3 mm? -68.86 116.26 9.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.726 -179.415 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.19 39.06 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.076 179.161 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.602 ' H ' ' C ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -136.71 -108.04 0.2 Allowed 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.941 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.555 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER 0.9 -80.59 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.069 0.547 . . . . 0.0 112.439 179.182 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.0 t -58.01 -58.07 10.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.889 179.848 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -52.83 -56.96 11.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.459 179.957 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -53.14 -52.52 58.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.352 179.46 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.8 m-20 -50.99 -50.16 58.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.29 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.534 ' C ' ' H ' ' A' ' 28' ' ' LEU . 1.2 m -51.83 -54.26 30.96 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.447 0.641 . . . . 0.0 109.331 178.696 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -61.25 14.75 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.683 -179.806 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.9 OUTLIER -167.2 -53.63 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.378 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -65.81 -13.26 59.15 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.569 0.223 . . . . 0.0 111.483 -178.884 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 31' ' ' HIS . 3.0 mmmp? -139.79 24.02 2.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.009 0.433 . . . . 0.0 110.776 179.875 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.441 ' C ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 34.0 38.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.089 179.636 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.76 179.99 6.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.909 0.385 . . . . 0.0 110.937 179.923 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 mmm-85 -92.27 -27.19 17.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.266 0.555 . . . . 0.0 109.837 179.724 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.6 p 178.37 -168.09 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.836 179.629 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.41 -177.16 47.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.352 179.975 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.45 -154.42 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -179.836 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.94 142.86 30.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.733 0.301 . . . . 0.0 110.574 179.493 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -146.88 164.41 32.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.124 0.487 . . . . 0.0 111.585 -179.41 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -101.59 119.3 38.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.078 -179.8 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.624 ' C ' ' H ' ' A' ' 42' ' ' LYS . 11.4 p-10 -51.75 168.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.623 179.703 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -64.22 36.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.495 -179.835 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.624 ' H ' ' C ' ' A' ' 40' ' ' ASP . 3.6 mmtp -146.86 -81.25 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.171 179.625 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -176.82 20.7 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.112 179.677 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.78 124.66 46.75 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.65 179.527 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.6 tp -89.51 138.48 31.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.389 179.424 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -147.61 145.8 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 111.63 -179.459 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -82.67 109.02 16.48 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.929 -179.96 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.9 mt -90.3 116.88 32.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.912 0.387 . . . . 0.0 111.86 -179.925 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.47 120.1 36.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.685 179.412 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.28 136.28 34.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.958 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -111.16 -6.34 14.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.598 -179.29 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.7 m . . . . . 0 C--O 1.232 0.178 0 CA-C-O 121.035 0.445 . . . . 0.0 111.822 -179.294 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.65 0 CA-C-O 120.85 0.357 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -79.82 5.54 13.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.113 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.417 ' CB ' ' HZ1' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -153.84 151.7 29.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.624 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.51 21.7 0.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.692 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.67 122.48 13.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.752 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.93 125.48 45.94 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.436 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -67.07 127.86 29.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.32 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.535 ' O ' ' C ' ' A' ' 9' ' ' GLU . 2.9 t80 -61.25 73.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 7' ' ' VAL . 15.0 mp0 16.36 -125.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.67 0.606 . . . . 0.0 111.139 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 57.8 t-20 -57.21 -122.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 6.5 t80 97.64 95.67 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.609 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.24 115.47 1.75 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 121.786 1.658 . . . . 0.0 111.486 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 15' ' ' LYS . 68.0 t -50.69 -50.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.884 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.478 ' C ' ' O ' ' A' ' 13' ' ' VAL . 69.6 p 19.12 -79.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.502 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 13' ' ' VAL . 21.3 tptp -65.44 -87.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.155 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.468 ' C ' ' O ' ' A' ' 15' ' ' LYS . 2.2 m 28.1 81.3 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 121.021 0.438 . . . . 0.0 111.625 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -142.26 -23.73 0.67 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.689 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.425 ' O ' ' O ' ' A' ' 19' ' ' ALA . 1.4 mt -165.17 -176.41 4.08 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.366 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -54.73 -157.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.118 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 21' ' ' GLN . 30.9 t30 76.38 -87.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.104 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.448 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -30.29 -90.37 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.729 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.6 m -55.68 -45.42 77.79 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -51.83 -71.74 0.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.428 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -49.91 -59.52 3.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.359 -179.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.9 m-20 -49.17 -54.75 14.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.541 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.0 m -54.74 -41.98 71.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -62.14 10.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.012 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.541 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.0 tt -165.49 -45.52 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.615 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 9.9 m-20 -67.16 -15.26 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.082 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -141.37 30.07 1.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.0 0.428 . . . . 0.0 110.808 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.453 ' C ' ' O ' ' A' ' 30' ' ' LYS . 4.5 m80 32.42 39.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.242 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 30' ' ' LYS . . . -87.69 -176.64 5.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.827 0.346 . . . . 0.0 111.037 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.96 -38.28 11.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.328 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -163.61 -157.08 0.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.401 179.595 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.519 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 163.07 169.21 26.17 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.143 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -178.05 170.2 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 55.4 m -86.7 127.39 34.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.767 0.318 . . . . 0.0 110.484 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -142.12 165.98 25.95 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.373 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -145.1 -178.1 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.856 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -121.79 -178.29 3.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.072 -179.906 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.32 42.97 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.399 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.539 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER -138.44 -25.29 0.93 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.932 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.539 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 2.2 tpt180 89.63 61.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.27 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 43' ' ' ARG . 4.9 m-20 -142.87 105.73 4.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.583 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.8 mt -86.57 136.2 33.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.543 0.687 . . . . 0.0 112.566 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.429 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 0.0 OUTLIER -145.67 153.87 41.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.22 179.4 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.535 ' SG ' ' CZ ' ' A' ' 11' ' ' TYR . 1.8 m -75.89 101.37 5.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.368 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.429 ' CD1' ' O ' ' A' ' 46' ' ' GLN . 2.1 mp -89.27 121.7 39.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.796 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.3 m -95.64 117.3 30.21 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.52 133.86 34.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.0 0.429 . . . . 0.0 111.542 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -103.63 -25.71 13.07 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.18 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.89 86.67 1.8 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.952 0.406 . . . . 0.0 111.159 -179.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -167.71 59.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.056 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.025 179.8 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.584 0 CA-C-O 120.868 0.366 . . . . 0.0 111.342 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.452 ' CG ' ' N ' ' A' ' 3' ' ' LYS . 5.7 p-10 -61.98 -55.08 33.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.202 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.452 ' N ' ' CG ' ' A' ' 2' ' ' ASP . 3.3 ttpp 51.64 94.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.974 0.416 . . . . 0.0 110.884 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 175.2 18.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.367 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -95.81 139.46 32.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.998 0.427 . . . . 0.0 111.275 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -140.39 101.83 4.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.818 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -61.8 130.39 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.814 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.477 ' O ' ' C ' ' A' ' 9' ' ' GLU . 1.1 t80 -72.66 67.33 0.77 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.477 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.0 mt-10 32.11 -149.7 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.302 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.61 ' CG ' ' H ' ' A' ' 11' ' ' TYR . 9.3 p30 -50.9 -67.33 0.26 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.401 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.61 ' H ' ' CG ' ' A' ' 10' ' ' ASN . 23.4 t80 99.4 128.72 0.02 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 C-N-CA 123.306 0.643 . . . . 0.0 110.585 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.557 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 72.6 Cg_exo -44.92 -69.16 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 121.353 1.369 . . . . 0.0 111.759 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.557 ' CG2' ' O ' ' A' ' 12' ' ' PRO . 66.2 t 110.44 18.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.801 1.313 . . . . 0.0 110.148 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.29 -21.52 65.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.639 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.94 141.04 0.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.923 0.392 . . . . 0.0 111.098 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -176.65 58.67 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.467 0.651 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.1 mm-40 -106.58 -22.72 12.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.704 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 mp -163.38 170.47 17.46 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.466 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 113.02 1.51 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.668 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -178.77 -95.9 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.172 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -46.11 -53.63 9.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.888 0.375 . . . . 0.0 110.319 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.1 t -60.55 -55.91 27.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.741 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -52.95 -65.98 0.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.468 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.531 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.29 -47.28 36.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.616 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.5 m-20 -53.55 -62.21 1.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.76 0.314 . . . . 0.0 110.531 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.521 ' C ' ' H ' ' A' ' 28' ' ' LEU . 99.3 m -54.4 -41.02 68.8 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.135 0.493 . . . . 0.0 109.968 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 5.24 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.917 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.521 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.4 tp -163.22 -47.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.375 -0.53 . . . . 0.0 112.256 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.616 ' N ' ' O ' ' A' ' 25' ' ' ASP . 72.9 m-20 -66.01 -10.95 44.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.241 0.543 . . . . 0.0 109.655 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 31' ' ' HIS . 4.2 tptt -143.33 9.79 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.067 179.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.43 ' C ' ' O ' ' A' ' 30' ' ' LYS . 3.3 p80 35.2 43.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.83 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.43 -166.21 1.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.835 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -33.95 11.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.626 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -174.06 -154.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.701 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.46 ' C ' ' OE1' ' A' ' 36' ' ' GLU . . . 152.73 179.65 28.45 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.532 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.46 ' OE1' ' C ' ' A' ' 35' ' ' GLY . 6.7 pm0 -177.53 175.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.671 -0.265 . . . . 0.0 110.307 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.09 148.94 22.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 0.0 111.4 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -146.61 146.02 30.28 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.434 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -76.87 151.44 35.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.103 0.478 . . . . 0.0 111.867 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -101.33 -179.89 4.16 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.759 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -64.7 -7.84 12.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.077 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.32 -80.4 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.08 32.68 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.75 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -128.87 144.53 51.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.82 0.343 . . . . 0.0 111.044 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.74 148.06 22.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.126 0.489 . . . . 0.0 111.162 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -141.78 147.51 37.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.061 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.413 ' SG ' ' CZ ' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -70.9 143.21 51.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 112.127 -179.214 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.0 mp -136.1 115.23 16.12 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.128 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.3 m -91.85 124.71 36.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.493 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -92.98 127.69 38.58 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.878 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -104.52 -3.33 24.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.135 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.1 m -114.91 -105.4 0.4 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.973 0.416 . . . . 0.0 111.06 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.592 ' CD ' ' H ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -165.67 -146.75 0.09 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.581 -179.736 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.592 ' H ' ' CD ' ' A' ' 53' ' ' GLU . 43.4 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.939 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.506 ' O ' ' OD1' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.445 -0.693 0 CA-C-O 121.124 0.488 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.525 ' CG ' ' N ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER 83.0 -160.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.028 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.525 ' N ' ' CG ' ' A' ' 2' ' ' ASP . 1.2 mmtm 55.4 151.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.165 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.42 -25.42 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.331 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.23 136.49 33.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.428 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -149.9 123.53 9.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.986 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.64 145.1 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.351 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.562 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.2 t80 -92.29 74.5 5.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.818 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.562 ' O ' ' O ' ' A' ' 8' ' ' TYR . 25.8 mt-10 21.12 110.15 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.789 0.681 . . . . 0.0 112.72 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.503 ' C ' ' O ' ' A' ' 9' ' ' GLU . 3.9 t30 15.67 56.94 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.204 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.646 ' CD2' ' SG ' ' A' ' 47' ' ' CYS . 87.4 t80 -54.13 110.15 1.94 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.023 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.563 ' C ' ' H ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.05 117.2 1.77 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.833 1.689 . . . . 0.0 112.148 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.2 41.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.065 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.563 ' H ' ' C ' ' A' ' 12' ' ' PRO . 25.2 p -63.68 -32.3 73.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.862 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -172.56 141.52 1.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.294 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -173.09 0.07 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -87.49 46.73 1.41 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.8 mt -167.48 -95.85 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.262 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . 170.81 -165.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.827 0.346 . . . . 0.0 110.146 -178.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.584 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.7 t30 60.6 -74.55 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.515 ' N ' ' O ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -35.62 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 109.969 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.71 -45.44 92.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.449 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -76.2 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.088 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.584 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -42.3 -41.01 2.64 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.634 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.55 ' O ' ' N ' ' A' ' 29' ' ' ASP . 1.2 m-20 -52.88 -61.51 2.25 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.509 ' C ' ' H ' ' A' ' 28' ' ' LEU . 73.4 m -51.79 -47.33 64.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.501 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -61.18 12.22 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.674 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.8 tt -166.6 -37.88 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -66.62 -14.57 62.59 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.692 -179.378 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -143.2 3.55 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.2 m170 63.51 43.35 5.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.723 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.48 -178.55 5.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.011 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -92.82 -35.09 13.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.321 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.7 p -172.37 -159.59 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.928 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.17 175.59 23.96 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.83 -1.176 . . . . 0.0 113.524 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -178.59 165.97 1.73 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.502 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.7 OUTLIER -88.16 146.62 25.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.011 0.434 . . . . 0.0 111.514 -179.159 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -144.84 160.03 41.94 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.312 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 40' ' ' ASP . 7.6 m-85 -94.38 86.62 4.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.717 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -42.34 167.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.776 0.322 . . . . 0.0 110.342 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.01 -0.32 0.68 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.93 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HZ3' HD21 ' A' ' 44' ' ' ASN . 7.2 mtmp? -110.46 17.63 20.6 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? 60.62 61.45 1.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.156 0.503 . . . . 0.0 110.595 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.483 ' O ' ' OD1' ' A' ' 40' ' ' ASP . 87.4 m-20 -147.12 129.74 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.681 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 39' ' ' TYR . 4.7 mt -85.43 100.73 12.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.423 ' OE1' ' OD2' ' A' ' 40' ' ' ASP . 20.3 mt-30 -113.53 145.96 40.39 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.467 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.1 m -82.5 101.49 10.74 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.982 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 mp -88.42 111.77 22.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 82.7 m -93.85 125.3 38.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.266 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 51' ' ' TYR . 65.3 t0 -95.19 140.74 29.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.959 0.409 . . . . 0.0 110.91 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.508 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 55.8 m-85 -128.91 66.8 1.42 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.323 -178.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.447 ' O ' ' C ' ' A' ' 53' ' ' GLU . 72.7 m -98.98 34.26 2.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.048 0.451 . . . . 0.0 110.875 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.541 ' N ' ' CD ' ' A' ' 53' ' ' GLU . 0.1 OUTLIER -34.87 -48.43 0.39 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.865 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.845 179.924 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.586 0 CA-C-O 120.777 0.322 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.5 p-10 -89.4 -44.31 10.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.706 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.403 ' NZ ' ' OE1' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -135.17 28.33 3.44 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.108 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.428 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.7 m 53.77 41.11 32.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.234 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.95 136.48 24.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 111.068 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.4 ' CB ' ' HZ1' ' A' ' 6' ' ' LYS . 7.4 mtmp? -151.83 133.19 14.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.142 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.72 152.56 9.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.367 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.446 ' C ' ' CD1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER -94.47 98.08 10.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.552 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -66.28 116.03 6.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.581 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -178.45 -98.58 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.136 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.431 ' OH ' ' OD2' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -53.8 149.79 15.81 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.583 -179.62 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.476 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 72.3 Cg_endo -75.16 10.91 1.62 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.464 2.109 . . . . 0.0 111.721 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.511 ' O ' ' CG1' ' A' ' 13' ' ' VAL . 97.8 t 102.06 2.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 124.72 1.262 . . . . 0.0 110.586 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.554 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 24.8 p -60.73 -75.08 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.554 ' N ' ' OG ' ' A' ' 14' ' ' SER . 29.6 mttm -66.96 102.58 1.0 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.225 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -172.37 28.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.416 -179.423 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -115.12 37.8 3.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.255 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 20' ' ' ASN . 0.5 OUTLIER -169.37 119.16 0.67 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.792 0.33 . . . . 0.0 111.159 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.23 52.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.165 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -140.87 -82.37 0.23 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.725 0.298 . . . . 0.0 111.24 -179.434 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 4.3 tp-100 -38.19 -61.69 0.64 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.911 0.386 . . . . 0.0 110.826 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.81 -54.62 39.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.251 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.45 -64.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.792 0.329 . . . . 0.0 110.247 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.455 ' CD1' ' O ' ' A' ' 24' ' ' TYR . 0.4 OUTLIER -50.64 -39.76 51.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.89 179.238 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.1 m-20 -55.36 -58.5 7.47 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.508 ' C ' ' H ' ' A' ' 28' ' ' LEU . 61.7 m -52.39 -43.55 64.82 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -59.62 7.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.583 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.7 tp -166.35 -37.02 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.515 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.5 m-20 -66.16 -13.27 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.371 . . . . 0.0 110.739 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -142.34 0.4 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.1 m80 64.33 45.43 3.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.945 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.75 -178.46 5.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.255 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.64 -32.01 12.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.305 0.574 . . . . 0.0 110.065 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.2 p 178.07 146.12 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.536 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.94 -177.16 23.7 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.845 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -178.62 168.63 1.75 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 0.0 110.918 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.8 m -88.8 132.22 34.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.437 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -143.79 164.83 29.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.534 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -91.41 104.52 17.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.996 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.571 ' C ' ' H ' ' A' ' 42' ' ' LYS . 8.9 p-10 -92.34 -177.48 4.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.041 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -63.29 39.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.616 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.571 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 21.11 1.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.869 0.366 . . . . 0.0 110.612 179.665 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 40.54 39.83 0.8 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.159 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -144.49 159.8 42.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.569 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 9.6 mt -85.4 94.98 9.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.688 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -90.47 139.94 30.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.396 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -83.8 93.77 8.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.9 mt -83.47 118.04 30.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.931 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 39.7 m -97.61 112.98 24.63 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.392 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -95.15 132.33 40.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 110.666 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.31 -42.69 7.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.548 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.609 ' O ' ' N ' ' A' ' 54' ' ' TYR . 23.0 m -108.7 -112.78 0.3 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.652 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.403 ' OE1' ' NZ ' ' A' ' 3' ' ' LYS . 12.4 tp10 38.8 -85.02 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.03 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.609 ' N ' ' O ' ' A' ' 52' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.305 -0.855 . . . . 0.0 110.35 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.575 0 CA-C-O 120.882 0.372 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.94 13.76 21.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt -119.01 123.14 43.79 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.671 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -164.36 -86.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.11 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.85 135.57 35.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.99 0.424 . . . . 0.0 111.235 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -147.89 130.52 15.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.104 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -64.44 127.68 25.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.502 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.607 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 28.8 t80 -74.56 2.55 9.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.253 0.549 . . . . 0.0 110.527 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.56 ' O ' ' C ' ' A' ' 10' ' ' ASN . 9.9 pt-20 32.54 -154.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.676 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.56 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 11.89 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.457 0.473 . . . . 0.0 111.676 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.452 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 4.6 t80 -176.81 133.23 0.38 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.099 -179.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.586 ' O ' ' N ' ' A' ' 14' ' ' SER . 61.0 Cg_endo -71.0 47.28 0.73 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.128 1.885 . . . . 0.0 112.135 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.515 ' C ' ' O ' ' A' ' 12' ' ' PRO . 2.8 t 12.02 54.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.713 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 12' ' ' PRO . 74.8 p -63.58 -125.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.7 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 32.4 mttm -67.45 161.28 25.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.64 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 1.3 m -173.42 93.89 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.386 0.613 . . . . 0.0 111.34 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.475 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER 156.46 -48.02 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.782 -1.099 . . . . 0.0 108.888 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.6 mt -75.59 125.47 29.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.732 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.86 92.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.367 . . . . 0.0 110.672 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.595 ' CG ' ' H ' ' A' ' 21' ' ' GLN . 19.4 t-20 -173.43 -121.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.595 ' H ' ' CG ' ' A' ' 20' ' ' ASN . 14.3 mm-40 -5.17 -79.45 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.918 0.761 . . . . 0.0 112.412 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -55.72 31.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.447 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 20' ' ' ASN . 4.4 t-20 -53.13 -61.62 2.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.346 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.74 -57.62 8.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -50.1 -53.67 25.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.218 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.698 ' C ' ' H ' ' A' ' 28' ' ' LEU . 84.0 m -57.69 -47.13 83.21 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.425 ' HZ2' ' CB ' ' A' ' 34' ' ' SER . 0.1 OUTLIER -61.24 11.0 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.119 178.454 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.698 ' H ' ' C ' ' A' ' 26' ' ' CYS . 9.1 tp -161.14 -137.5 0.04 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 52.25 -78.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.678 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -101.32 -4.6 26.74 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 177.631 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.461 ' CD2' ' C ' ' A' ' 30' ' ' LYS . 10.5 m-70 70.19 65.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.263 178.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.21 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.264 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.479 HH21 ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.08 -34.03 10.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.293 0.568 . . . . 0.0 109.654 179.472 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.479 ' CB ' HH21 ' A' ' 33' ' ' ARG . 96.5 p -176.51 -169.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.035 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -153.76 174.12 32.36 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.108 -1.044 . . . . 0.0 113.349 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.86 143.51 0.43 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 99.5 m -90.05 157.18 17.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.062 0.458 . . . . 0.0 111.985 -179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -147.24 142.28 27.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.851 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -86.29 173.19 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 111.618 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.593 ' C ' ' H ' ' A' ' 42' ' ' LYS . 29.1 p-10 -118.89 178.88 4.32 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.737 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.67 25.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.959 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.593 ' H ' ' C ' ' A' ' 40' ' ' ASP . 14.3 tppt? -145.26 -77.78 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.968 0.413 . . . . 0.0 109.932 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.588 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -179.12 12.57 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.29 179.762 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.433 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 0.6 OUTLIER -90.7 133.51 35.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.942 0.401 . . . . 0.0 110.673 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.4 mt -90.93 160.27 15.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -141.96 136.01 29.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.038 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.93 100.42 12.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.471 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.457 ' N ' ' CD1' ' A' ' 48' ' ' ILE . 1.2 mp -89.62 116.41 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.594 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -94.78 119.26 33.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.652 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -94.07 123.17 37.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.571 0.7 . . . . 0.0 111.876 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -97.31 -94.43 0.22 Allowed 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.563 179.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.1 m 52.22 23.57 2.42 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.007 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 71.1 tt0 -41.25 101.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.095 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.508 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 CA-C-O 120.775 0.322 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -166.1 86.19 0.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 mttt 64.84 164.99 0.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.006 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.04 37.36 0.12 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.715 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.08 126.96 11.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.883 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.57 137.24 16.94 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.486 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.64 146.65 11.82 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.155 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.492 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.5 t80 -73.36 -16.12 61.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.361 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.642 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 88.23 143.34 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.643 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.493 ' C ' ' O ' ' A' ' 9' ' ' GLU . 13.6 t-20 15.33 46.61 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.926 0.766 . . . . 0.0 112.508 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.642 ' N ' ' O ' ' A' ' 9' ' ' GLU . 39.0 t80 -59.05 122.6 64.17 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.892 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -41.43 86.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.944 1.763 . . . . 0.0 112.031 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.55 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -53.17 97.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.039 0.447 . . . . 0.0 111.392 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -177.59 -82.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.333 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -68.71 99.33 1.0 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.601 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -172.59 105.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.494 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 169.37 36.11 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -166.6 145.29 5.44 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.887 0.375 . . . . 0.0 111.103 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.63 55.32 0.01 OUTLIER 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.237 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.601 ' N ' ' O ' ' A' ' 18' ' ' LEU . 7.1 t-20 -148.75 -115.06 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.604 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.568 ' H ' ' CG ' ' A' ' 20' ' ' ASN . 1.2 mp0 3.41 -79.76 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 123.74 0.65 . . . . 0.0 112.241 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -56.11 26.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.928 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -53.12 -61.26 2.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.319 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.537 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.45 -54.52 26.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.363 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.429 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.0 m-20 -51.35 -66.42 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.315 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.576 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.6 m -47.23 -43.92 22.24 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.94 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -59.48 8.71 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.924 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.576 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.9 tp -164.28 -36.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.942 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.429 ' N ' ' O ' ' A' ' 25' ' ' ASP . 15.4 m-20 -70.23 -21.42 63.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.862 0.363 . . . . 0.0 110.875 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' CG ' ' OH ' ' A' ' 51' ' ' TYR . 3.8 tptp -136.11 5.69 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.061 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.53 31.91 20.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.795 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.33 -177.73 6.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.93 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -99.08 -23.88 15.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.637 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.406 ' CB ' HD22 ' A' ' 23' ' ' ASN . 1.7 p -175.06 -165.32 0.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.864 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.53 -175.7 46.57 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.55 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -175.96 146.44 0.7 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.928 0.394 . . . . 0.0 111.316 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.24 105.83 18.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -99.85 125.19 45.77 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.003 0.43 . . . . 0.0 112.082 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -73.98 174.36 8.7 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.103 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 3.0 p30 -173.52 156.15 2.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.748 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.478 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.2 pt-20 16.45 -74.53 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.872 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -99.09 45.43 1.0 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.382 -179.148 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.572 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 23.5 66.0 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.808 179.612 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.443 ' C ' ' CD2' ' A' ' 45' ' ' LEU . 0.6 OUTLIER -97.75 -3.76 38.42 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.443 ' CD2' ' C ' ' A' ' 44' ' ' ASN . 1.2 pt? 36.74 93.83 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.21 0.529 . . . . 0.0 112.018 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mp0 -94.12 138.11 32.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.803 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.449 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -77.0 98.11 4.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.809 -178.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.5 mt -86.51 114.56 26.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.708 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 65.6 m -91.31 117.73 29.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.467 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.578 ' OD1' ' N ' ' A' ' 53' ' ' GLU . 6.6 t70 -95.26 127.83 41.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.0 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.454 ' OH ' ' CG ' ' A' ' 30' ' ' LYS . 39.4 m-85 -97.47 4.82 50.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.727 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.4 m -140.25 -76.22 0.33 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.408 . . . . 0.0 110.435 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.578 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 1.0 OUTLIER 50.85 16.1 0.3 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.028 179.693 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.198 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.582 0 CA-C-O 120.797 0.332 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.501 ' O ' ' O ' ' A' ' 3' ' ' LYS . 25.1 t70 53.38 41.37 32.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.501 ' O ' ' O ' ' A' ' 2' ' ' ASP . 20.1 mttp 42.5 104.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.274 0.559 . . . . 0.0 111.29 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.24 20.05 13.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.767 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.8 141.04 27.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.976 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 134.68 24.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.958 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -61.48 131.67 26.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.681 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.6 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -67.14 -3.03 6.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.498 ' O ' ' O ' ' A' ' 10' ' ' ASN . 4.9 mt-10 90.46 -123.41 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.905 0.753 . . . . 0.0 110.398 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.569 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 10.5 m120 -53.47 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.269 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.569 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 24.1 t80 102.29 137.94 0.01 OUTLIER Pre-proline 0 N--CA 1.47 0.55 0 O-C-N 123.73 0.644 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.58 83.95 1.66 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.096 1.864 . . . . 0.0 112.226 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.0 t -52.61 106.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.002 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.6 p -173.51 -80.17 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.928 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -65.99 -17.79 64.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.911 0.386 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.497 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -65.15 84.07 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.46 179.832 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.2 mm-40 -132.85 -11.39 3.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.316 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.8 mt -165.48 167.08 17.87 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.935 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.541 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -57.28 137.1 56.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.58 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.554 ' CG ' ' N ' ' A' ' 21' ' ' GLN . 1.6 t-20 150.45 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.257 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.554 ' N ' ' CG ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -50.03 -55.18 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.217 179.847 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.0 t -59.45 -54.62 44.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.458 ' C ' HD21 ' A' ' 23' ' ' ASN . 0.4 OUTLIER -52.11 -67.84 0.22 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.762 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.558 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.11 -46.65 53.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.963 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.1 m-20 -49.2 -61.24 2.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.533 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.534 ' C ' ' H ' ' A' ' 28' ' ' LEU . 92.2 m -55.03 -42.73 72.98 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.587 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -60.17 7.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.323 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.2 tp -164.42 -20.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 25' ' ' ASP . 2.0 m-20 -68.27 -64.52 0.85 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.781 0.324 . . . . 0.0 110.648 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mttp -101.06 12.66 37.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.65 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.8 m170 68.3 39.35 2.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.194 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.72 -177.04 5.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.907 0.384 . . . . 0.0 111.323 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.67 -37.74 11.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.502 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.582 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.7 p -177.64 -140.33 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.627 0.251 . . . . 0.0 110.786 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.582 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 124.53 -159.31 19.16 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.727 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.77 171.8 2.18 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.35 131.83 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 111.567 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -149.42 -171.19 3.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.241 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.595 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 6.6 m-85 -90.65 141.61 28.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.944 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.599 ' C ' ' H ' ' A' ' 42' ' ' LYS . 1.3 p-10 -99.3 171.2 8.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.356 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -64.19 36.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.382 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.599 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.6 OUTLIER -143.01 8.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.057 0.456 . . . . 0.0 110.316 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' C ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 59.93 58.86 2.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.571 -179.726 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 2.3 m120 -143.82 -138.18 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.056 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.484 ' O ' ' OE1' ' A' ' 46' ' ' GLN . 27.0 tp -155.12 129.25 8.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.88 0.372 . . . . 0.0 111.414 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.484 ' OE1' ' O ' ' A' ' 45' ' ' LEU . 1.0 OUTLIER -145.76 175.81 10.12 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.214 0.531 . . . . 0.0 111.105 -179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.414 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -95.25 103.47 15.33 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.092 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.3 mm -83.2 113.1 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 111.011 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -95.91 125.42 40.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.433 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.57 ' OD1' ' N ' ' A' ' 51' ' ' TYR . 61.5 t0 -94.29 143.09 26.69 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.503 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.57 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 81.7 m-85 -129.32 31.33 4.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.302 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -94.57 -82.25 0.37 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.063 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.535 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 1.0 OUTLIER 86.28 -67.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.899 0.381 . . . . 0.0 110.288 -179.316 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.852 179.556 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.625 0 CA-C-O 120.876 0.369 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.5 ' O ' ' C ' ' A' ' 3' ' ' LYS . 3.2 p-10 -138.99 -117.79 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.181 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.534 ' C ' ' H ' ' A' ' 5' ' ' LYS . 66.8 mttt 23.12 83.28 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 O-C-N 123.398 0.436 . . . . 0.0 111.536 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.5 m -64.29 5.74 0.24 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.187 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.534 ' H ' ' C ' ' A' ' 3' ' ' LYS . 2.5 tptt -138.76 127.37 23.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.194 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -144.87 110.02 5.15 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.101 0.477 . . . . 0.0 111.417 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.5 m -69.36 143.49 14.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.522 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.517 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.7 OUTLIER -89.86 71.76 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.002 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.94 71.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.321 -178.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.531 ' O ' ' C ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER 177.94 -79.16 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.536 179.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.548 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.3 t80 -0.42 114.4 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.448 0 O-C-N 123.915 0.759 . . . . 0.0 112.438 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.431 ' O ' ' N ' ' A' ' 14' ' ' SER . 86.8 Cg_exo -44.11 98.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.0 t -54.29 87.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.933 0.396 . . . . 0.0 111.131 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.453 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 1.7 p -176.2 139.44 0.36 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.59 ' C ' ' H ' ' A' ' 17' ' ' GLN . 0.5 OUTLIER 84.2 8.54 0.52 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -67.95 21.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.814 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.59 ' H ' ' C ' ' A' ' 15' ' ' LYS . 1.6 mp0 -94.93 18.27 12.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 mt -166.96 147.03 5.56 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.012 0.434 . . . . 0.0 111.18 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.444 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.52 -178.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.967 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.615 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.5 OUTLIER 80.22 -72.42 0.07 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.757 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.7 OUTLIER -54.91 77.07 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.359 179.578 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ASN . 66.8 m 125.98 -54.29 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.601 1.16 . . . . 0.0 109.04 -178.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -55.16 -54.91 37.24 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.453 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -56.18 -53.86 52.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.977 178.66 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -46.73 -51.84 15.28 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.731 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.652 ' C ' ' H ' ' A' ' 28' ' ' LEU . 55.6 m -59.31 -43.45 92.65 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -58.08 4.16 0.02 OUTLIER 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.583 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.652 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.7 tp -164.8 -124.99 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.075 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 36.88 -81.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.73 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.645 ' N ' ' O ' ' A' ' 28' ' ' LEU . 2.2 mptp? -92.78 14.92 15.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.936 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.582 ' N ' ' O ' ' A' ' 28' ' ' LEU . 22.3 m170 62.97 49.71 3.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.862 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.542 ' CB ' ' O ' ' A' ' 26' ' ' CYS . . . -90.37 -173.29 3.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.83 0.348 . . . . 0.0 110.586 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -114.3 -31.77 6.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.828 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.9 p -165.99 -168.11 1.2 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.41 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . 160.68 175.22 31.45 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.353 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -176.77 176.38 1.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 111.007 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.0 m -88.27 136.92 32.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.856 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -143.19 131.22 21.75 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.843 0.354 . . . . 0.0 111.664 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -72.42 166.82 21.82 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.476 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.405 ' OD1' ' N ' ' A' ' 44' ' ' ASN . 1.3 p30 -139.99 179.27 6.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.99 -14.78 51.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.49 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.95 5.98 49.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.988 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 18.6 ttp180 62.65 53.72 2.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.722 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.405 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 10.0 m-80 -143.95 135.55 26.04 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.626 ' CD2' ' H ' ' A' ' 45' ' ' LEU . 0.2 OUTLIER -92.1 104.85 17.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.09 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 137.86 32.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.561 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 21.1 m -82.53 104.51 12.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.105 0.478 . . . . 0.0 110.884 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.41 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 17.1 mt -87.03 124.4 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.779 -178.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -98.37 113.84 25.96 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.944 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 53' ' ' GLU . 8.8 t70 -93.45 154.93 17.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.013 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.6 -33.4 2.54 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.15 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -142.39 0.58 1.32 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.293 -179.269 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.588 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 9.6 pm0 35.36 34.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.01 0.433 . . . . 0.0 110.607 -179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.453 ' O ' ' O ' ' A' ' 53' ' ' GLU . 4.4 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.856 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 120.771 0.32 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.74 65.91 1.88 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.153 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.2 mtpt -65.17 -139.71 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.862 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.1 m -145.85 0.0 0.83 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.583 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -93.68 133.22 37.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.554 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.16 127.34 13.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 111.074 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.58 146.04 13.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.9 OUTLIER -70.51 90.53 0.74 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.62 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -62.29 74.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.241 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.62 ' ND2' ' O ' ' A' ' 9' ' ' GLU . 20.2 p30 125.15 118.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.728 1.211 . . . . 0.0 109.968 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 42.1 t80 178.56 140.22 0.26 Allowed Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.318 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.7 73.66 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.145 1.897 . . . . 0.0 112.43 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.0 t -55.38 99.75 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.874 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.0 p -175.89 -66.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.914 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -65.57 -3.92 5.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.967 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.42 83.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.107 0.48 . . . . 0.0 110.631 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.425 ' H ' HD13 ' A' ' 18' ' ' LEU . 40.1 mt-30 -145.87 22.78 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.296 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.602 ' CD1' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -164.42 129.73 2.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.076 0.465 . . . . 0.0 110.447 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.27 74.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.905 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.607 ' O ' ' N ' ' A' ' 23' ' ' ASN . 12.5 t-20 -162.39 -113.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.526 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.556 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -3.18 -78.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.719 0.637 . . . . 0.0 112.098 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.6 t -58.89 -54.35 48.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 110.786 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' ASN . 60.3 t30 -52.17 -64.85 0.68 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.232 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.479 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.54 -41.9 61.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.257 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.497 ' O ' ' N ' ' A' ' 29' ' ' ASP . 1.5 m-20 -54.39 -71.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.13 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.505 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -51.97 -32.18 32.32 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.248 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -59.57 0.2 0.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.396 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.505 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.8 tt -164.93 -26.72 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.717 0.294 . . . . 0.0 111.667 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.497 ' N ' ' O ' ' A' ' 25' ' ' ASP . 1.3 m-20 -69.37 -52.59 25.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 110.822 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.88 11.72 34.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.492 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.8 m170 62.11 33.22 17.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.886 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.2 -179.79 6.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -29.59 13.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 110.398 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.5 p -179.13 -169.94 0.16 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.141 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 169.13 179.77 41.33 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.334 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -175.68 153.62 1.45 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -88.67 137.06 32.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.838 0.352 . . . . 0.0 111.212 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -147.56 152.45 37.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.45 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -57.08 -173.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.855 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 26.4 p-10 -170.75 85.07 0.1 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 40' ' ' ASP . 4.8 pt-20 30.56 27.8 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.821 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 1.5 mtpt -148.59 6.11 0.72 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.727 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 66.55 -2.82 0.97 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.128 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 42' ' ' LYS . 7.8 m-80 -95.42 140.34 30.43 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.513 ' N ' ' CD1' ' A' ' 45' ' ' LEU . 2.3 mp -78.97 155.42 28.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.666 0.745 . . . . 0.0 112.778 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.433 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -142.95 132.95 24.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.105 179.2 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.7 m -75.52 98.57 3.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.433 ' CD1' ' O ' ' A' ' 46' ' ' GLN . 1.8 mp -86.66 107.39 16.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.36 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.3 m -97.97 119.19 36.15 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.819 0.343 . . . . 0.0 111.278 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -93.86 129.91 40.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -95.59 -32.65 12.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.054 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -143.62 -84.79 0.15 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.499 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 16.8 tt0 146.7 -14.29 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.497 0.498 . . . . 0.0 110.488 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.454 ' C ' ' O ' ' A' ' 53' ' ' GLU . 3.5 m-30 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.93 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.618 0 CA-C-O 120.891 0.377 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.65 -60.62 2.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.021 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.4 mtmm -123.83 126.48 46.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.929 0.395 . . . . 0.0 110.891 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -91.56 8.41 36.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.186 -179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.51 158.26 43.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.424 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.48 119.29 6.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.042 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.572 ' C ' ' H ' ' A' ' 9' ' ' GLU . 2.9 m -63.29 139.22 21.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.905 0.383 . . . . 0.0 110.985 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.544 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 28.5 t80 -51.06 -5.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.808 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.583 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 28.0 mt-10 91.15 6.79 0.07 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.368 0.667 . . . . 0.0 111.39 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.583 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 52.5 t-20 113.47 74.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.1 0.875 . . . . 0.0 111.669 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 22' ' ' CYS . 4.1 t80 -54.11 144.05 40.76 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.532 ' O ' ' C ' ' A' ' 13' ' ' VAL . 19.7 Cg_endo -60.13 40.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.194 1.929 . . . . 0.0 112.678 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 11' ' ' TYR . 76.9 t 8.15 81.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 123.325 0.65 . . . . 0.0 112.598 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.5 p -175.77 20.8 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -172.05 101.74 0.17 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.163 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.8 OUTLIER -170.95 1.77 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.55 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -78.16 50.95 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.064 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.459 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 2.2 mp -165.22 -114.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.773 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 165.67 46.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 0.0 110.703 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 21' ' ' GLN . 3.2 t-20 -137.9 -63.62 0.56 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.49 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.8 tp-100 -39.83 -72.23 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.866 0.365 . . . . 0.0 110.601 -179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 5.1 m -62.68 -45.18 93.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -50.34 -67.31 0.27 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.579 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.529 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.83 -50.82 55.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -43.39 -57.27 3.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.63 ' C ' ' H ' ' A' ' 28' ' ' LEU . 76.1 m -58.55 -45.33 89.15 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -57.05 0.48 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.508 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.794 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.1 tp -165.54 -131.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.501 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 35.3 -68.69 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 123.675 0.609 . . . . 0.0 112.481 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.794 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -87.47 -5.43 58.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.983 0.42 . . . . 0.0 110.098 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.547 ' N ' ' O ' ' A' ' 28' ' ' LEU . 1.6 m170 79.17 36.3 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.039 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.522 ' CB ' ' O ' ' A' ' 26' ' ' CYS . . . -89.89 -179.69 5.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.578 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 53.0 mtt-85 -99.55 -28.75 13.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.228 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.5 p -175.95 -159.67 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.519 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.92 -176.16 41.38 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.936 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -176.34 158.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.819 0.342 . . . . 0.0 110.495 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.6 m -88.88 147.91 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.215 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -139.3 132.24 29.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.747 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -89.78 139.21 30.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.91 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.599 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -93.48 76.42 4.44 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.096 0.474 . . . . 0.0 110.783 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' A' ' 40' ' ' ASP . 2.3 pt-20 19.02 44.94 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.631 -1.168 . . . . 0.0 112.114 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.9 mtpm? -142.3 -65.83 0.4 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.554 ' CG ' ' O ' ' A' ' 42' ' ' LYS . 2.3 mmm180 167.79 -21.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.915 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -87.98 172.35 9.63 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.544 ' N ' ' CD1' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -149.53 168.97 22.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.497 0.665 . . . . 0.0 112.527 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -135.92 141.57 44.54 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.346 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 90.3 m -92.6 103.43 15.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.108 -179.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 57.7 mt -84.54 120.17 34.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.614 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.1 m -92.76 116.1 28.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -90.76 120.77 32.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.244 0.545 . . . . 0.0 111.121 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.578 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 66.5 m-85 -97.81 13.62 29.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.654 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 54' ' ' TYR . 73.0 m -142.64 -102.38 0.13 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.913 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 48.62 -91.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.864 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.435 ' N ' ' O ' ' A' ' 52' ' ' CYS . 84.6 m-85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.922 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 120.679 0.275 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.514 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 3.1 p30 -142.18 42.36 1.66 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.077 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.2 mmtm -79.3 121.78 25.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.69 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -94.6 8.83 40.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.382 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.26 134.26 19.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.808 0.337 . . . . 0.0 110.674 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.97 131.8 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -64.55 141.57 18.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.419 ' HB3' ' H ' ' A' ' 9' ' ' GLU . 0.4 OUTLIER -44.52 -85.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.65 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.512 ' O ' ' N ' ' A' ' 11' ' ' TYR . 2.0 mt-10 -178.07 -155.3 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.702 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.56 ' O ' ' C ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -39.17 -25.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.562 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.684 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 2.3 t80 1.67 91.68 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.86 0.725 . . . . 0.0 111.685 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.519 ' O ' ' C ' ' A' ' 13' ' ' VAL . 60.6 Cg_endo -74.14 59.16 4.45 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 121.836 1.69 . . . . 0.0 112.269 -179.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.595 ' CG2' ' H ' ' A' ' 14' ' ' SER . 7.3 p 6.83 -119.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.452 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.595 ' H ' ' CG2' ' A' ' 13' ' ' VAL . 1.4 p 84.83 -2.78 0.93 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.039 0.447 . . . . 0.0 110.06 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.436 ' CG ' ' C ' ' A' ' 14' ' ' SER . 2.4 mttt -164.41 108.7 0.95 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.327 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -172.67 97.7 0.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.046 0.451 . . . . 0.0 111.142 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.483 ' CG ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mt-30 -172.71 23.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.304 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.82 146.33 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.525 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.26 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.133 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.58 ' O ' ' N ' ' A' ' 23' ' ' ASN . 4.1 t-20 -173.8 -132.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.061 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.573 ' H ' ' CG ' ' A' ' 20' ' ' ASN . 13.4 mm-40 8.32 -87.43 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.979 0.8 . . . . 0.0 112.379 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 39.6 m -53.46 -56.68 14.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.955 0.407 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.58 ' N ' ' O ' ' A' ' 20' ' ' ASN . 2.5 t30 -52.46 -64.79 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.488 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -51.91 -50.97 60.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.135 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.602 ' O ' ' N ' ' A' ' 29' ' ' ASP . 67.8 m-20 -51.39 -60.27 3.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.889 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.474 ' C ' ' H ' ' A' ' 28' ' ' LEU . 66.9 m -54.51 -41.38 69.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.037 0.446 . . . . 0.0 110.169 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.461 ' HZ3' ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -59.48 3.75 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.17 -179.608 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.474 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.9 tt -163.27 -36.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.285 -0.566 . . . . 0.0 112.324 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 25' ' ' ASP . 85.4 m-20 -68.07 -44.07 77.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.801 0.334 . . . . 0.0 110.662 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.6 10.73 26.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m80 42.37 48.21 4.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.059 0.457 . . . . 0.0 110.008 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.97 -177.69 6.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.655 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.597 ' NE ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -101.67 -30.11 11.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.046 0.45 . . . . 0.0 110.343 179.851 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.584 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.2 OUTLIER -172.99 155.19 3.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.278 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.484 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 165.04 175.17 35.51 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.547 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 38' ' ' PHE . 10.8 pt-20 -178.2 -162.64 0.06 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.781 0.324 . . . . 0.0 110.734 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -87.06 129.22 35.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.279 179.475 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 36' ' ' GLU . 34.7 m-85 -147.05 167.07 24.98 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.334 0.587 . . . . 0.0 111.857 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.526 ' O ' ' O ' ' A' ' 40' ' ' ASP . 65.0 m-85 -98.17 -117.59 0.14 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.801 178.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.526 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.1 OUTLIER 51.4 149.55 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.42 0.629 . . . . 0.0 112.014 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.471 ' CG ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 89.41 -56.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.474 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.473 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 1.9 ttmt -149.63 30.61 0.74 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 54.72 18.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.995 0.426 . . . . 0.0 110.311 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.473 ' OD1' ' O ' ' A' ' 42' ' ' LYS . 6.6 m-20 -95.75 125.5 40.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.697 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.436 ' CD1' ' CE1' ' A' ' 39' ' ' TYR . 6.6 tp -85.78 112.4 21.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.813 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -142.22 161.32 38.31 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 112.23 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.684 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 73.0 m -75.62 96.66 3.6 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.873 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.3 mt -90.27 117.17 33.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.358 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 59.7 m -93.48 110.53 22.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.038 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' SER . 0.9 OUTLIER -93.1 160.67 14.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.786 0.803 . . . . 0.0 112.265 -178.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 4' ' ' CYS . 87.4 m-85 -128.35 -28.41 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.209 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m -98.58 -3.09 37.04 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.749 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 74.71 -83.93 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.128 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.047 -179.851 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 120.794 0.33 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 50.74 -172.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.652 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.505 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 3.3 mmtt -97.55 125.62 42.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.705 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.505 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.1 m 165.86 23.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.172 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.85 154.87 43.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.726 0.298 . . . . 0.0 110.765 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -151.12 121.14 7.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.293 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -63.06 116.35 2.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.564 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -55.52 76.45 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.129 -179.476 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 7' ' ' VAL . 50.5 mt-10 8.81 117.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.511 ' C ' ' O ' ' A' ' 9' ' ' GLU . 6.0 m-20 14.47 52.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.613 ' O ' ' N ' ' A' ' 13' ' ' VAL . 87.4 t80 -54.6 136.61 62.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -40.43 84.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 121.852 1.701 . . . . 0.0 111.768 179.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -56.61 106.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.53 -179.061 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 89.2 p -175.75 -86.55 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.06 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.605 ' CB ' ' HZ1' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -69.59 159.28 33.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.949 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.581 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.0 m -170.58 -79.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.678 0.275 . . . . 0.0 111.393 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' LEU . 2.4 mp0 63.08 13.22 6.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.151 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.473 ' C ' ' O ' ' A' ' 17' ' ' GLN . 4.4 mp 28.38 57.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.325 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 173.86 35.53 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.03 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.574 ' O ' ' N ' ' A' ' 23' ' ' ASN . 1.2 t-20 -174.5 -118.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.652 ' N ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -1.01 -83.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.997 0.811 . . . . 0.0 112.209 179.534 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 0.3 OUTLIER -58.57 -50.78 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.256 -179.755 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -51.55 -69.04 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.931 0.396 . . . . 0.0 110.51 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.47 -47.12 66.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.935 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' A' ' 29' ' ' ASP . 94.9 m-20 -56.9 -67.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.602 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.579 ' C ' ' H ' ' A' ' 28' ' ' LEU . 4.3 m -50.42 -40.52 50.46 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.227 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -58.91 5.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.665 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.579 ' H ' ' C ' ' A' ' 26' ' ' CYS . 3.2 tm? -163.46 -40.92 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.878 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 25' ' ' ASP . 32.4 m-20 -68.21 -53.07 27.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.746 0.307 . . . . 0.0 111.298 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -99.74 18.63 17.68 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.904 0.383 . . . . 0.0 111.097 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 41.46 35.65 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.886 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.44 -171.91 3.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.16 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -95.17 -48.0 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.825 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.476 ' O ' ' OD2' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -163.48 145.8 9.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.076 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.4 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -114.91 178.21 17.79 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.895 -0.669 . . . . 0.0 113.314 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.4 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 4.8 mt-10 -174.66 139.98 0.57 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -88.78 145.28 25.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 0.0 110.896 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -144.04 142.16 30.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.929 0.395 . . . . 0.0 110.718 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.478 ' O ' ' OD2' ' A' ' 40' ' ' ASP . 63.2 m-85 -72.21 -177.7 2.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.866 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.589 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.3 OUTLIER 163.35 -172.2 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.419 0.628 . . . . 0.0 111.195 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.8 OUTLIER 24.95 -82.23 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.143 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.604 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 26.2 mmtt -134.26 79.29 1.8 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.831 0.348 . . . . 0.0 111.645 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 46.65 28.38 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.121 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.604 ' OD1' ' N ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -94.44 122.83 37.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.622 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 12.1 mt -89.08 109.11 20.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.685 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -93.22 135.84 34.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.657 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.487 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.3 m -77.21 100.97 5.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -86.78 116.73 29.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.556 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 99.2 m -93.76 111.47 23.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.865 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.476 ' OD2' ' O ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -88.0 143.32 27.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.524 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -112.46 -3.9 14.34 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.86 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.9 m -140.04 -118.25 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.741 0.305 . . . . 0.0 110.761 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 179.03 19.57 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.022 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.946 -179.465 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.65 0 CA-C-O 120.888 0.375 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.443 ' O ' ' CB ' ' A' ' 3' ' ' LYS . 1.0 OUTLIER -72.21 -101.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.333 179.638 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.581 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER 161.46 83.87 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.766 179.667 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.581 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.3 m 160.05 37.81 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.657 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.01 139.17 25.92 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.032 0.444 . . . . 0.0 111.55 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.694 ' HZ2' ' HH ' ' A' ' 51' ' ' TYR . 25.8 pttt -151.77 140.72 21.08 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.754 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.98 154.94 3.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 121.22 0.533 . . . . 0.0 111.818 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.714 ' CE2' ' CZ ' ' A' ' 11' ' ' TYR . 57.1 t80 -91.05 -16.77 27.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.602 -178.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.53 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 22.48 110.97 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.367 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 11' ' ' TYR . 1.4 t-20 170.27 -71.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 177.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.714 ' CZ ' ' CE2' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -46.72 173.54 0.04 OUTLIER Pre-proline 0 C--O 1.231 0.087 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.708 179.73 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.543 ' O ' ' CG1' ' A' ' 13' ' ' VAL . 16.7 Cg_exo -66.05 -14.84 46.28 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.358 1.372 . . . . 0.0 110.189 178.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.543 ' CG1' ' O ' ' A' ' 12' ' ' PRO . 1.9 p 103.94 -20.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.224 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.78 -33.67 75.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.682 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -69.19 147.26 51.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 110.57 179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -175.55 -75.74 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 49.56 29.91 3.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.2 0.524 . . . . 0.0 110.072 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.3 mt 44.69 -133.45 0.75 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.408 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.23 80.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.562 ' O ' ' N ' ' A' ' 22' ' ' CYS . 1.8 t-20 -176.83 -117.14 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.902 0.382 . . . . 0.0 111.69 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.591 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 1.8 tp60 -57.73 54.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 112.277 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.591 ' SG ' ' O ' ' A' ' 21' ' ' GLN . 1.7 m 177.8 -58.79 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.527 ' C ' HD21 ' A' ' 23' ' ' ASN . 0.2 OUTLIER -59.19 -52.0 67.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.387 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -48.9 78.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.879 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 29' ' ' ASP . 3.7 m-20 -52.8 -53.91 41.63 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.348 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.529 ' C ' ' H ' ' A' ' 28' ' ' LEU . 71.7 m -53.39 -46.62 69.75 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 13.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.511 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.529 ' H ' ' C ' ' A' ' 26' ' ' CYS . 52.7 tp -165.27 -36.37 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.415 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.515 ' N ' ' O ' ' A' ' 25' ' ' ASP . 65.1 m-20 -68.62 -44.43 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.623 0.249 . . . . 0.0 111.021 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.471 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 42.2 mmtt -107.79 -0.16 21.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.195 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.471 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER 75.78 35.7 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.13 177.39 7.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.213 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -107.43 -5.37 17.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.577 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.406 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER 174.39 -169.26 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.365 -179.815 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -173.65 -165.03 29.8 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.636 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.502 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 2.0 mt-10 -176.44 -164.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 110.366 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.4 m -144.17 132.35 21.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.628 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -146.62 169.86 18.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.071 0.462 . . . . 0.0 111.531 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.614 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.0 m-85 -100.84 120.15 39.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.639 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.681 ' O ' ' N ' ' A' ' 42' ' ' LYS . 5.3 p-10 -122.65 123.38 41.02 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 40' ' ' ASP . 15.2 tt0 21.74 35.17 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.855 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.681 ' N ' ' O ' ' A' ' 40' ' ' ASP . 19.4 mtmm -147.1 -6.24 0.5 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.687 0.279 . . . . 0.0 111.34 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 31.6 mmt-85 57.56 10.08 0.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.008 0.432 . . . . 0.0 110.049 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 10.2 m-20 -94.73 -130.91 0.15 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.303 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.3 mt -152.95 95.17 1.94 Allowed 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.453 ' NE2' ' CG ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -89.7 156.1 18.77 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 178.702 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 13.3 m -106.65 115.18 29.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.062 0.458 . . . . 0.0 111.292 -178.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 23.0 mt -88.93 132.29 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.727 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 92.1 m -100.38 112.47 24.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.005 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.415 ' H ' ' HA2' ' A' ' 35' ' ' GLY . 0.4 OUTLIER -94.24 140.51 29.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.203 0.525 . . . . 0.0 111.302 -179.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.694 ' HH ' ' HZ2' ' A' ' 6' ' ' LYS . 71.7 m-85 -113.46 -24.91 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.167 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -145.16 64.04 1.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.174 -179.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -86.15 31.98 0.63 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.832 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.192 -0.908 . . . . 0.0 110.927 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.579 0 CA-C-O 120.814 0.34 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' A' ' 3' ' ' LYS . 2.9 m-20 -144.41 143.6 31.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.741 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 2' ' ' ASP . 5.0 mttp -38.66 106.42 0.05 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.83 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -179.65 21.59 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.992 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -118.11 134.14 55.27 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.858 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.599 ' HZ1' ' HH ' ' A' ' 51' ' ' TYR . 0.8 OUTLIER -149.22 125.49 10.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.998 0.428 . . . . 0.0 111.27 179.401 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.33 144.27 14.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.434 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.51 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.5 t80 -84.68 61.89 7.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.926 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.574 ' O ' ' N ' ' A' ' 11' ' ' TYR . 4.1 mm-40 32.94 -159.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.625 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -58.73 44.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.207 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.586 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 7.0 t80 -52.92 134.41 48.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.567 ' C ' ' H ' ' A' ' 14' ' ' SER . 84.6 Cg_exo -39.32 85.54 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.156 1.904 . . . . 0.0 112.475 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' TYR . 9.6 p -57.48 1.3 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.401 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.567 ' H ' ' C ' ' A' ' 12' ' ' PRO . 35.7 p -62.94 -95.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.286 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.401 ' H ' ' HG ' ' A' ' 14' ' ' SER . 0.4 OUTLIER -66.66 113.79 5.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.007 0.432 . . . . 0.0 111.447 -179.468 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -175.06 108.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.205 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -143.24 -23.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.674 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.13 -178.94 4.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 110.961 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.43 112.1 1.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.57 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.407 ' OD1' ' OE1' ' A' ' 21' ' ' GLN . 0.8 OUTLIER -175.55 -105.66 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.782 179.42 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.494 ' O ' ' OD2' ' A' ' 25' ' ' ASP . 9.6 mm100 -50.05 -55.89 12.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.851 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.7 t -55.7 -57.38 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.26 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -51.45 -64.88 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.874 0.368 . . . . 0.0 110.625 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.552 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.69 -47.03 64.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.326 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.555 ' O ' ' N ' ' A' ' 29' ' ' ASP . 20.1 m-20 -52.12 -64.71 0.73 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.538 ' C ' ' H ' ' A' ' 28' ' ' LEU . 89.9 m -51.32 -50.32 59.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -61.87 14.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.712 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.538 ' H ' ' C ' ' A' ' 26' ' ' CYS . 3.3 tm? -163.73 -41.01 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.265 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.555 ' N ' ' O ' ' A' ' 25' ' ' ASP . 3.5 m-20 -67.43 -47.61 69.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.418 ' HZ1' ' CB ' ' A' ' 30' ' ' LYS . 3.1 mtpm? -101.25 6.53 42.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.829 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.401 ' CD2' ' N ' ' A' ' 31' ' ' HIS . 0.1 OUTLIER 58.15 36.66 26.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.535 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.75 -174.77 5.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.038 0.447 . . . . 0.0 111.467 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.4 tpt85 -93.87 -25.96 17.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.7 p -176.35 -164.11 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.287 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 159.83 176.02 31.45 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.792 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -177.0 164.43 2.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 0.0 110.437 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 136.82 33.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.872 0.368 . . . . 0.0 110.519 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -146.73 162.16 39.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 23.0 m-85 -86.07 175.95 8.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.03 0.443 . . . . 0.0 111.462 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.627 ' C ' ' H ' ' A' ' 42' ' ' LYS . 17.9 p-10 -109.41 173.21 6.42 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.322 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.506 ' OE1' ' N ' ' A' ' 41' ' ' GLU . 53.0 mp0 -65.14 27.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.673 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.627 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 -74.15 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.571 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.467 ' O ' ' CG ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER 169.71 70.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.387 179.631 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 70.8 m-80 -141.61 -155.42 0.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.428 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.55 137.05 21.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.807 0.337 . . . . 0.0 110.608 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -146.97 139.69 25.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.586 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -82.65 100.2 10.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.318 179.517 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.2 mm -82.89 112.58 20.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.556 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.7 m -95.76 117.51 30.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.227 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.446 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 0.1 OUTLIER -95.01 143.65 26.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.929 0.395 . . . . 0.0 110.727 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.599 ' HH ' ' HZ1' ' A' ' 6' ' ' LYS . 7.8 m-85 -114.23 -26.67 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.611 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.482 ' O ' ' O ' ' A' ' 53' ' ' GLU . 62.2 m -95.06 -111.15 0.13 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.743 0.306 . . . . 0.0 110.887 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.487 ' O ' ' OE1' ' A' ' 53' ' ' GLU . 1.0 OUTLIER 49.66 107.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.884 -179.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.861 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.551 0 CA-C-O 120.755 0.312 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.42 ' O ' ' C ' ' A' ' 3' ' ' LYS . 5.3 t0 -165.51 -39.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 2' ' ' ASP . 12.2 ttmt -37.0 133.19 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.751 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 15.2 m -94.94 5.83 50.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.047 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.61 153.35 40.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.763 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -149.71 128.92 12.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.116 0.484 . . . . 0.0 111.638 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.6 m -64.34 146.3 13.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.615 179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.75 76.96 7.15 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.559 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.5 pt-20 -61.58 82.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.416 -178.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 1.3 t-20 153.73 -2.82 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.286 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.639 ' CE1' ' SG ' ' A' ' 47' ' ' CYS . 3.9 t80 -55.83 129.43 71.64 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.632 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.535 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.4 Cg_exo -59.77 45.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 121.91 1.74 . . . . 0.0 113.256 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.566 ' N ' ' O ' ' A' ' 11' ' ' TYR . 36.0 t 2.97 93.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 123.705 0.628 . . . . 0.0 112.665 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.714 ' HG ' ' H ' ' A' ' 15' ' ' LYS . 85.1 p -171.22 -97.41 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.154 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.714 ' H ' ' HG ' ' A' ' 14' ' ' SER . 18.0 tttp -63.93 117.11 6.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.95 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.425 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -172.0 -12.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.019 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -80.39 33.18 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.597 0.237 . . . . 0.0 110.79 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.425 ' H ' ' C ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -166.96 116.97 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.724 -179.672 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.77 99.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.654 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.488 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.6 OUTLIER -168.82 -86.78 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -45.55 -61.0 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.306 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.574 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.6 t -58.16 -54.46 46.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.43 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.443 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 2.2 t30 -51.03 -63.4 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.497 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.44 -47.94 62.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.243 179.312 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' A' ' 29' ' ' ASP . 14.6 m-20 -50.81 -62.6 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.546 ' C ' ' H ' ' A' ' 28' ' ' LEU . 80.4 m -53.85 -41.4 67.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -59.99 7.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.063 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.546 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -162.36 -40.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.045 -179.375 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 25' ' ' ASP . 71.8 m-20 -67.35 -54.28 21.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.767 0.318 . . . . 0.0 111.004 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 1.3 mmmm -102.25 29.9 4.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.888 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 7.9 m170 33.09 39.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.427 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.01 -176.11 5.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.678 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -95.92 -26.12 15.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.07 0.462 . . . . 0.0 110.458 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.451 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -175.17 -159.14 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.07 -179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.451 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 164.72 -172.0 40.32 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.978 -1.106 . . . . 0.0 113.456 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 4.9 tt0 -177.07 -144.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.914 0.388 . . . . 0.0 110.521 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.09 133.84 17.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.648 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -149.66 -177.96 6.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.222 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -90.31 -166.79 1.67 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.863 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.515 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -176.41 -173.07 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.612 -179.755 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -60.52 -2.57 0.52 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.399 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' ' 44' ' ' ASN . 6.0 mmtp -100.81 -1.43 34.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.086 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 59.47 -2.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.243 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.56 ' H ' ' C ' ' A' ' 42' ' ' LYS . 2.1 m120 -94.97 158.81 15.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.695 0.283 . . . . 0.0 110.749 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mt -87.84 133.2 33.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -146.5 157.2 43.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.187 0.518 . . . . 0.0 111.363 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.639 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -70.77 157.33 38.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.121 -179.72 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -143.43 111.85 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.953 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.8 m -92.22 119.0 31.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.887 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -92.7 158.39 15.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.441 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -129.92 -36.11 1.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 34.5 m -97.54 -113.39 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.918 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 54' ' ' TYR . 76.5 mm-40 -131.31 -118.62 0.22 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.628 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.47 ' O ' ' O ' ' A' ' 53' ' ' GLU . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.022 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.403 ' O ' ' CB ' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.447 -0.625 0 CA-C-O 120.861 0.362 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.403 ' CB ' ' O ' ' A' ' 1' ' ' PCA . 9.2 t0 75.49 -1.22 3.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.565 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -110.64 -5.1 15.11 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.944 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.8 m -157.77 50.28 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.378 . . . . 0.0 110.986 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 138.4 26.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.939 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.432 ' C ' ' CG1' ' A' ' 7' ' ' VAL . 3.6 mtpm? -147.84 -156.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.128 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.432 ' CG1' ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -168.52 158.84 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.627 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.13 114.31 22.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.034 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -65.42 4.91 0.47 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.412 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.627 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 9.3 p30 178.23 136.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.727 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.6 t80 -179.42 100.92 0.19 Allowed Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.928 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.642 ' O ' ' N ' ' A' ' 14' ' ' SER . 80.7 Cg_exo -45.39 65.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.885 2.39 . . . . 0.0 113.624 -178.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.727 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.4 t 8.98 51.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 123.967 0.907 . . . . 0.0 113.297 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.642 ' N ' ' O ' ' A' ' 12' ' ' PRO . 2.8 p -68.7 135.64 51.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 0.0 111.915 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 26.66 32.37 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.579 ' N ' ' O ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -71.52 82.05 0.81 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.469 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -161.53 -42.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.977 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -73.06 -103.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.501 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.52 22.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.506 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.591 ' O ' ' N ' ' A' ' 22' ' ' CYS . 18.5 t-20 -114.59 -112.16 0.34 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.021 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.563 ' C ' ' O ' ' A' ' 20' ' ' ASN . 11.6 mm-40 0.89 -68.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.775 0.672 . . . . 0.0 111.827 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 42.7 t -60.94 -68.15 0.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.694 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.5 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -47.17 -46.96 23.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.226 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.05 -48.97 78.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.096 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 21' ' ' GLN . 12.5 m-20 -52.37 -57.0 11.2 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.393 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.679 ' C ' ' H ' ' A' ' 28' ' ' LEU . 91.6 m -58.13 -44.05 87.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -61.43 11.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.54 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.699 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.2 tp -160.89 -134.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.071 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 40.41 -76.87 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.175 0.297 . . . . 0.0 111.77 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 28' ' ' LEU . 9.9 mmtp -90.6 -9.16 48.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 110.557 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.455 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 3.3 m170 79.91 49.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.206 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.92 -136.57 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.157 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -141.45 -53.63 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.665 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -155.92 133.34 10.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.641 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.45 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . -105.98 -157.19 22.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.5 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -172.14 131.54 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 87.2 m -90.36 123.3 33.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.724 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.436 ' CE1' ' CG1' ' A' ' 48' ' ' ILE . 23.2 p90 -149.16 140.7 23.39 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 120.513 -0.475 . . . . 0.0 112.017 -179.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -72.69 133.87 44.8 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.66 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 42' ' ' LYS . 13.1 p-10 -146.68 -166.13 2.41 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.458 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.488 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.4 tt0 22.23 42.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.186 -178.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.58 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.2 mtpt 68.96 83.05 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.207 178.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.4 ttp85 61.54 52.73 3.56 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.002 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -93.34 -60.31 1.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 11.9 tp 76.92 67.19 0.05 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.296 -178.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -91.87 -175.96 4.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.015 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -127.27 123.56 36.74 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.534 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -87.58 155.05 3.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.499 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.3 m -135.28 108.7 7.85 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.039 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -94.29 134.77 36.42 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -101.36 -24.67 14.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.93 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.476 ' O ' ' OE2' ' A' ' 53' ' ' GLU . 4.1 m -139.98 -116.89 0.13 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.019 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.476 ' OE2' ' O ' ' A' ' 52' ' ' CYS . 0.1 OUTLIER 157.6 -107.52 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.046 0.451 . . . . 0.0 110.656 179.425 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.474 ' H ' ' CG ' ' A' ' 53' ' ' GLU . 95.3 m-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.999 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 CA-C-O 120.954 0.407 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -148.81 153.05 37.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.587 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -104.67 113.18 26.59 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.144 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.6 m -96.25 -0.48 49.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.346 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.409 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -118.38 126.89 53.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.914 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.45 138.03 47.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.069 0.462 . . . . 0.0 111.787 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.407 HG22 ' H ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -61.41 146.98 11.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.62 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.609 ' O ' ' CG ' ' A' ' 8' ' ' TYR . 2.2 t80 -92.11 42.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.962 0.41 . . . . 0.0 110.429 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.543 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 4.5 pt-20 17.83 76.96 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.031 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.543 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 7.3 m120 103.74 145.41 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.059 0.849 . . . . 0.0 110.827 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 13' ' ' VAL . 39.4 t80 -179.32 123.7 0.24 Allowed Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.421 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_exo -41.75 82.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.293 1.995 . . . . 0.0 112.733 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.575 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.1 t -55.21 95.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 p -175.26 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -26.3 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.101 0.477 . . . . 0.0 110.123 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.449 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -68.09 90.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.735 179.236 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.416 ' H ' HD13 ' A' ' 18' ' ' LEU . 30.2 mt-30 -158.29 21.4 0.24 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.652 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.625 ' CD1' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -165.69 -79.55 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.739 0.304 . . . . 0.0 111.044 -179.588 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.537 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -178.01 -159.83 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 -178.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.501 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.2 OUTLIER 60.83 -72.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.381 -179.462 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 19' ' ' ALA . 6.0 mm-40 -39.49 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.6 t -59.57 -46.41 88.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.704 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -76.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.234 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.497 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.58 -43.33 35.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.467 179.926 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 29' ' ' ASP . 46.0 m-20 -50.37 -60.54 2.89 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.578 ' C ' ' H ' ' A' ' 28' ' ' LEU . 81.9 m -55.97 -39.53 71.94 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.275 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -59.69 7.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.836 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.8 tt -163.35 -26.07 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.638 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 25' ' ' ASP . 17.8 m-20 -70.03 -51.81 29.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 110.649 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 3.7 mmmm -110.21 0.24 18.1 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.969 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.499 ' CD2' ' N ' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 66.75 41.53 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.429 -179.594 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.83 -178.61 6.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.365 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -95.65 -10.57 29.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.071 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.451 ' OG ' ' OE1' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 174.67 -169.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.987 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.71 170.24 37.61 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.835 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.04 153.19 0.78 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -88.43 137.16 32.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.569 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -146.4 159.99 42.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -69.65 -168.64 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.612 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -161.64 156.69 23.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.461 0.648 . . . . 0.0 112.67 -179.782 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 40' ' ' ASP . 5.1 mm-40 11.73 -69.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.378 -1.283 . . . . 0.0 114.137 179.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -88.75 -57.1 3.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.388 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER 164.25 31.44 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.903 0.382 . . . . 0.0 110.02 -179.738 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.498 ' N ' HD21 ' A' ' 44' ' ' ASN . 0.9 OUTLIER -94.68 135.77 35.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.594 179.458 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -86.43 131.93 34.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.179 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.418 ' OE1' ' OD2' ' A' ' 40' ' ' ASP . 38.1 mt-30 -142.25 165.47 27.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.543 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.458 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -97.19 103.69 15.65 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.413 -179.494 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.9 mm -93.69 119.81 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.1 m -94.49 123.37 37.87 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.208 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.566 ' OD1' ' N ' ' A' ' 53' ' ' GLU . 15.1 t70 -94.67 136.9 34.44 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.179 0.514 . . . . 0.0 111.373 -179.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -110.68 -9.61 14.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.56 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 3.7 m -135.23 -43.76 0.71 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.566 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 13.1 tp10 82.56 -64.1 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.046 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.558 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 120.84 0.352 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.5 t70 42.79 36.92 0.92 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.98 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -169.68 167.36 9.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.487 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 62.9 m -146.02 -3.65 0.66 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.412 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.519 ' CB ' ' HZ1' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -100.15 118.95 37.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.451 179.461 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -149.82 115.8 5.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.053 0.454 . . . . 0.0 112.103 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -70.69 148.0 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.683 ' CD1' ' ND2' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -103.96 -7.44 20.37 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.027 179.58 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 8' ' ' TYR . 2.0 tm-20 30.23 104.82 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.105 -0.952 . . . . 0.0 112.095 -178.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.751 HD21 ' N ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER 170.5 -44.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.264 179.003 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.751 ' N ' HD21 ' A' ' 10' ' ' ASN . 55.0 t80 -53.62 139.37 49.98 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.737 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.517 ' C ' ' H ' ' A' ' 14' ' ' SER . 94.5 Cg_exo -39.59 95.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.081 1.854 . . . . 0.0 112.058 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.2 p -53.02 -7.17 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.517 ' H ' ' C ' ' A' ' 12' ' ' PRO . 96.9 p -65.25 -88.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.082 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.427 ' N ' ' OG ' ' A' ' 14' ' ' SER . 35.8 tptt -66.02 139.65 58.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.756 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.75 22.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.915 0.388 . . . . 0.0 110.974 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -113.77 57.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.185 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.586 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -168.88 124.99 0.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.96 54.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.552 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' A' ' 18' ' ' LEU . 9.8 t-20 -159.82 -73.81 0.07 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.442 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.581 ' O ' ' CB ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -53.05 90.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.969 179.299 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.581 ' CB ' ' O ' ' A' ' 21' ' ' GLN . 52.3 t 120.61 -57.95 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.613 1.196 . . . . 0.0 109.878 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 0.1 OUTLIER -56.5 -54.7 42.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.031 0.443 . . . . 0.0 109.854 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.519 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -55.18 -48.2 74.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.185 179.147 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -53.09 -51.27 62.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.069 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.655 ' C ' ' H ' ' A' ' 28' ' ' LEU . 22.2 m -56.27 -44.31 79.64 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.6 tttp -60.76 12.27 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.132 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.655 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -162.16 -129.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.664 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.462 ' N ' ' CD1' ' A' ' 28' ' ' LEU . 0.4 OUTLIER 40.05 -81.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.706 0.289 . . . . 0.0 111.292 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.648 ' N ' ' O ' ' A' ' 28' ' ' LEU . 18.0 mttm -95.3 5.25 52.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.5 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.563 ' N ' ' O ' ' A' ' 28' ' ' LEU . 3.3 m170 71.94 56.47 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.457 ' CB ' ' O ' ' A' ' 26' ' ' CYS . . . -89.58 177.53 6.52 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.494 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -96.78 -21.83 17.31 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.094 0.473 . . . . 0.0 109.864 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.494 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 1.5 p 158.59 137.86 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.049 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.439 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -128.67 -173.17 13.36 Favored Glycine 0 CA--C 1.51 -0.221 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.398 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -179.0 158.95 0.96 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 0.0 110.531 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.8 m -87.17 138.51 31.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.579 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -138.24 157.48 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.876 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -93.22 -169.76 2.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.794 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.595 ' C ' ' H ' ' A' ' 42' ' ' LYS . 30.2 p30 -166.58 -172.3 2.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -65.04 18.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.827 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.595 ' H ' ' C ' ' A' ' 40' ' ' ASP . 12.3 mmtp -138.25 17.89 2.78 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.929 0.395 . . . . 0.0 111.043 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.11 13.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.463 179.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.404 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 91.2 m-20 -94.67 141.33 28.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.808 0.337 . . . . 0.0 111.166 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 mt -87.78 147.35 25.21 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.943 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.404 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 2.5 mp0 -147.05 134.49 20.8 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.29 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . 1.5 m -77.42 102.19 6.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.435 0.636 . . . . 0.0 112.391 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.0 mt -89.28 117.34 32.44 Favored 'Isoleucine or valine' 0 C--N 1.341 0.208 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.077 178.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.2 m -93.97 115.61 27.98 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 110.101 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.465 ' OD2' ' O ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.05 129.24 44.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.447 0.642 . . . . 0.0 110.597 179.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -102.38 -12.41 17.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.001 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.8 m -145.78 83.57 1.65 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.051 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.444 ' O ' ' O ' ' A' ' 54' ' ' TYR . 3.3 tt0 -164.07 72.67 0.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.844 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' GLU . 34.9 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.871 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.644 0 CA-C-O 120.661 0.267 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.14 155.0 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.852 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.12 17.03 10.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.624 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.2 m -157.96 13.72 0.21 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.32 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.9 pttt -146.26 131.47 18.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.852 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -145.44 124.94 13.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.409 . . . . 0.0 111.088 -179.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.04 129.28 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.43 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.97 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.604 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 176.13 -173.43 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.556 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.723 ' O ' ' O ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -19.51 -42.13 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.968 -179.756 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.723 ' O ' ' O ' ' A' ' 10' ' ' ASN . 59.1 t80 20.15 131.11 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.614 ' C ' ' H ' ' A' ' 14' ' ' SER . 49.0 Cg_endo -67.62 102.35 0.72 Allowed 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.98 1.787 . . . . 0.0 112.624 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.3 t -59.83 10.83 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.767 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.614 ' H ' ' C ' ' A' ' 12' ' ' PRO . 95.7 p -61.0 -5.58 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.599 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -166.78 127.85 1.65 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.016 0.436 . . . . 0.0 111.211 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 60.9 m -166.42 11.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.76 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.4 8.13 41.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.518 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.403 ' CD1' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -159.51 136.98 9.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.21 0.528 . . . . 0.0 110.495 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.406 ' HB2' HD21 ' A' ' 23' ' ' ASN . . . -59.41 113.85 2.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.667 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.519 ' O ' ' C ' ' A' ' 21' ' ' GLN . 0.6 OUTLIER -175.83 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.844 179.441 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.519 ' C ' ' O ' ' A' ' 20' ' ' ASN . 72.0 tp60 -16.34 -74.37 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.92 0.763 . . . . 0.0 112.009 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.534 ' N ' ' HH ' ' A' ' 11' ' ' TYR . 4.3 t -57.98 -49.25 77.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.513 ' N ' ' O ' ' A' ' 20' ' ' ASN . 44.8 t-20 -53.8 -69.56 0.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.144 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -38.96 32.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.562 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 29' ' ' ASP . 13.9 m-20 -55.45 -63.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.394 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.503 ' C ' ' H ' ' A' ' 28' ' ' LEU . 16.4 m -56.38 -38.95 72.15 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.57 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.196 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.503 ' H ' ' C ' ' A' ' 26' ' ' CYS . 3.3 tm? -163.24 -41.17 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.5 -0.48 . . . . 0.0 112.046 -179.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.551 ' N ' ' O ' ' A' ' 25' ' ' ASP . 96.6 m-20 -68.26 -16.44 63.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 110.895 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -143.33 22.69 1.85 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.237 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 40.74 39.58 0.8 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.11 0.481 . . . . 0.0 111.131 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.37 -173.79 4.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.846 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.55 -40.74 9.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.229 0.537 . . . . 0.0 110.494 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -161.28 175.46 12.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.686 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -158.77 146.58 13.33 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.408 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -175.73 156.52 1.86 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.419 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 2.8 m -88.38 145.19 25.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.432 0.634 . . . . 0.0 112.553 -178.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -143.3 163.37 33.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.437 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.4 166.75 22.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.707 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.487 ' O ' ' C ' ' A' ' 41' ' ' GLU . 2.1 p30 -171.53 176.11 3.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.635 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.487 ' C ' ' O ' ' A' ' 40' ' ' ASP . 69.7 mm-40 15.42 -90.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.687 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 mtpt -99.68 63.8 1.25 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.734 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 40.41 50.18 2.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.374 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.28 121.25 42.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.553 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.77 86.65 7.35 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -99.36 144.36 28.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.226 -178.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.672 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -63.02 101.42 0.27 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.322 179.601 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mt -92.59 120.79 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.108 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.4 m -92.47 116.3 28.87 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.26 139.65 30.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.245 0.545 . . . . 0.0 111.281 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -109.42 -22.47 12.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.296 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.541 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -146.73 -59.44 0.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.318 . . . . 0.0 111.27 -179.439 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.541 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 8.7 tt0 90.25 -78.95 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.693 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.803 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.628 0 CA-C-O 120.757 0.313 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 t70 44.28 85.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.558 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm 60.49 -168.27 0.17 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.656 -179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.4 m -156.24 -40.91 0.08 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.168 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.911 0.386 . . . . 0.0 111.513 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.43 ' C ' ' CG1' ' A' ' 7' ' ' VAL . 38.8 mttt -144.99 -164.46 1.93 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.301 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.43 ' CG1' ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -167.69 157.16 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.432 . . . . 0.0 110.971 -179.42 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.604 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.86 107.78 17.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.991 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.49 4.88 0.33 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.604 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 4.9 p30 172.96 123.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.987 0.423 . . . . 0.0 110.701 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.558 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER 178.66 156.79 0.6 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.439 -179.843 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.404 ' C ' ' O ' ' A' ' 11' ' ' TYR . 41.5 Cg_exo -30.11 84.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 123.31 2.674 . . . . 0.0 112.939 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.558 ' N ' ' O ' ' A' ' 11' ' ' TYR . 8.8 t -57.2 -36.74 52.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.546 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.33 -49.96 73.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.028 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -64.48 99.13 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.964 0.411 . . . . 0.0 110.388 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -172.08 110.64 0.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.286 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.495 ' O ' ' O ' ' A' ' 18' ' ' LEU . 75.7 mt-30 -137.36 52.85 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.583 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 20.8 mt 32.87 97.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.98 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.583 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 99.99 146.48 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 O-C-N 123.679 0.612 . . . . 0.0 111.422 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.61 ' C ' ' H ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER 63.66 -79.3 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.671 179.359 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.53 39.99 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.61 ' H ' ' C ' ' A' ' 20' ' ' ASN . 9.9 t -179.58 -52.82 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.441 ' C ' ' OD1' ' A' ' 23' ' ' ASN . 10.8 t-20 -58.26 -54.24 49.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.146 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.523 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -57.39 -44.36 84.43 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.71 178.868 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 29' ' ' ASP . 0.1 OUTLIER -54.3 -58.64 6.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.521 179.729 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.589 ' C ' ' H ' ' A' ' 28' ' ' LEU . 85.1 m -55.11 -42.1 72.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -62.28 12.26 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.697 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.589 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.2 tp -162.86 -44.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.631 -179.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.641 ' N ' ' O ' ' A' ' 25' ' ' ASP . 94.1 m-20 -68.34 -17.41 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.056 0.455 . . . . 0.0 110.496 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.429 ' NZ ' ' O ' ' A' ' 7' ' ' VAL . 41.8 mttt -140.24 3.63 1.97 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.05 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.4 m170 53.23 35.9 21.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.965 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.46 -167.76 1.99 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -97.17 -44.75 6.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.023 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 84.0 p -157.69 -155.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.099 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 158.23 -171.53 35.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.448 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -175.98 162.61 2.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.933 0.397 . . . . 0.0 111.123 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 73.3 m -88.81 138.1 31.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.092 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -148.74 146.82 28.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.922 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -86.36 160.64 19.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.622 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -93.33 -172.92 3.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.618 179.587 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -65.49 19.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.54 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.622 ' H ' ' C ' ' A' ' 40' ' ' ASP . 13.4 mtpp -140.93 -73.41 0.34 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.092 179.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.453 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 9.8 mtp85 153.45 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.644 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.47 ' O ' ' O ' ' A' ' 45' ' ' LEU . 0.7 OUTLIER -109.48 -0.25 18.95 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -178.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.47 ' O ' ' O ' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 57.3 136.77 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.752 0.311 . . . . 0.0 111.074 179.791 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -147.78 170.62 17.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.837 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.12 108.99 13.98 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.095 0.474 . . . . 0.0 111.515 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.9 mt -87.06 129.25 38.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.51 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.5 m -110.11 118.73 37.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.853 0.358 . . . . 0.0 111.187 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -96.55 152.95 18.15 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.794 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -130.23 3.62 4.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.958 -179.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.542 ' O ' ' O ' ' A' ' 53' ' ' GLU . 40.9 m -142.49 -110.83 0.13 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.423 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.542 ' O ' ' O ' ' A' ' 52' ' ' CYS . 6.6 mp0 20.75 107.06 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.503 0.502 . . . . 0.0 112.254 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.161 -0.924 . . . . 0.0 110.757 179.773 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.662 0 CA-C-O 120.836 0.35 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -76.26 -134.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.91 -179.912 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.475 ' C ' ' H ' ' A' ' 5' ' ' LYS . 14.3 mttp 66.21 126.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.061 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.16 15.34 0.33 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.729 179.923 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.475 ' H ' ' C ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -141.11 113.99 8.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.435 179.828 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -98.54 125.36 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.189 -179.098 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.98 146.25 13.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.626 178.801 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.57 84.22 6.81 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.096 0.474 . . . . 0.0 109.8 179.246 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.585 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -67.08 113.91 5.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.687 179.839 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.585 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 23.3 t-20 117.17 -34.25 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 O-C-N 124.144 0.902 . . . . 0.0 110.698 179.835 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.577 ' O ' ' O ' ' A' ' 12' ' ' PRO . 38.2 t80 -41.25 140.32 1.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.241 -179.995 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.577 ' O ' ' O ' ' A' ' 11' ' ' TYR . 72.6 Cg_exo -48.22 -146.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.413 2.075 . . . . 0.0 113.408 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.431 ' CG2' ' C ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -169.99 74.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.449 -179.984 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.9 p -174.17 -64.93 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -67.72 97.28 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.256 179.103 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 0.8 OUTLIER -170.97 113.0 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.44 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mm-40 156.72 -48.85 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.897 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' C ' ' A' ' 19' ' ' ALA . 10.9 mt -71.16 52.86 0.17 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.004 -179.542 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.544 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 3.78 84.97 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.974 0.797 . . . . 0.0 112.26 179.313 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.485 ' O ' ' C ' ' A' ' 21' ' ' GLN . 2.7 t-20 -164.18 -96.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.283 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.485 ' C ' ' O ' ' A' ' 20' ' ' ASN . 16.2 mm-40 -28.88 -76.8 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.489 -179.514 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.2 t -48.12 -64.95 0.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.904 0.383 . . . . 0.0 111.616 -179.735 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.504 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 2.8 t30 -47.63 -70.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.681 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -50.61 -43.32 56.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.3 m-20 -51.77 -65.59 0.53 Allowed 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.509 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.443 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.5 m -52.8 -42.08 64.74 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.068 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.9 tttp -59.14 1.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.747 -179.698 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.443 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.0 tt -167.81 -44.8 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.732 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 14.3 m-20 -64.62 -2.19 2.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.944 0.402 . . . . 0.0 110.78 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.421 ' H ' ' C ' ' A' ' 28' ' ' LEU . 37.7 mttm -144.75 8.58 1.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.33 179.338 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 53.48 36.03 22.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.768 179.978 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.11 -178.21 5.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 111.451 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.452 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -93.68 -31.32 14.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.465 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.1 p -176.72 -160.9 0.07 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.776 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.504 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 146.68 173.41 17.89 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.249 -0.977 . . . . 0.0 112.775 179.615 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.415 ' HG3' ' H ' ' A' ' 37' ' ' CYS . 0.4 OUTLIER -176.49 179.01 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.844 0.354 . . . . 0.0 110.652 179.964 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.415 ' H ' ' HG3' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -87.44 103.29 15.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.531 179.712 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -95.22 152.49 18.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.417 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.635 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 20.0 m-85 -96.5 -166.8 1.47 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.287 179.269 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.619 ' C ' ' H ' ' A' ' 42' ' ' LYS . 14.1 p-10 -133.68 -174.06 3.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.815 0.34 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.69 28.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.858 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.619 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -145.6 -81.76 0.15 Allowed 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.268 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.08 39.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.441 179.142 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.635 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 2.7 m120 -90.17 -168.1 2.03 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.143 -179.315 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 7.7 mt -152.3 133.64 14.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 111.619 -179.552 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -148.51 137.81 21.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.114 179.065 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.09 96.2 6.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.96 0.41 . . . . 0.0 111.217 -179.351 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.72 114.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.713 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -93.14 115.06 27.72 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -87.92 142.94 27.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.969 0.414 . . . . 0.0 111.584 -178.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -118.01 -27.26 6.18 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.485 -179.663 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.453 ' C ' ' H ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -143.98 86.5 1.86 Allowed 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.276 -179.358 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -69.91 47.85 0.09 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.493 179.407 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.619 ' O ' ' CD1' ' A' ' 54' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.473 -179.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.538 0 CA-C-O 120.911 0.386 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.488 ' O ' ' C ' ' A' ' 3' ' ' LYS . 2.2 m-20 -79.7 -167.65 1.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.83 -179.885 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.488 ' C ' ' O ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER -20.68 137.29 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.717 0.635 . . . . 0.0 111.936 -179.93 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.7 m -175.26 -22.02 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.886 179.97 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm -138.0 129.08 27.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -148.89 126.47 11.68 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.815 0.341 . . . . 0.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -63.22 158.28 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.338 179.055 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.463 ' O ' ' C ' ' A' ' 9' ' ' GLU . 23.5 t80 -82.64 -15.75 50.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.055 0.455 . . . . 0.0 111.433 -179.368 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.463 ' C ' ' O ' ' A' ' 8' ' ' TYR . 1.9 pt-20 26.57 78.8 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.724 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.417 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 3.7 m-20 165.1 -41.23 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.204 179.513 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -52.16 108.86 1.18 Allowed Pre-proline 0 CA--C 1.535 0.401 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.593 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.615 ' O ' ' N ' ' A' ' 14' ' ' SER . 94.2 Cg_endo -81.57 70.41 7.32 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.179 1.919 . . . . 0.0 112.299 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.495 ' C ' ' O ' ' A' ' 12' ' ' PRO . 2.6 t 18.85 44.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 123.85 0.719 . . . . 0.0 112.142 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.615 ' N ' ' O ' ' A' ' 12' ' ' PRO . 3.7 p -67.42 -7.58 26.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.512 -179.929 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.494 ' O ' ' C ' ' A' ' 16' ' ' CYS . 30.0 tptt -172.35 -88.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.381 -179.712 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.5 OUTLIER 26.37 97.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.397 -179.787 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -144.17 1.76 1.11 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.157 -179.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mt -164.24 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.297 -179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 176.58 109.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.794 -179.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -179.13 -82.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.336 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.452 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 3.3 tp60 -46.45 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.224 -179.414 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.28 -40.18 85.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.523 -179.57 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -53.23 -65.94 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.41 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.563 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -52.24 -42.2 63.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.033 178.882 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.9 m-20 -50.79 -60.73 2.75 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.815 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.527 ' C ' ' H ' ' A' ' 28' ' ' LEU . 57.0 m -54.86 -49.9 70.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 178.379 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 17.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.869 179.503 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 26' ' ' CYS . 3.5 tm? -165.47 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.018 -0.673 . . . . 0.0 112.262 -179.395 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.643 ' N ' ' O ' ' A' ' 25' ' ' ASP . 11.0 m-20 -67.77 -11.73 59.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.743 0.306 . . . . 0.0 111.16 -179.507 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 31' ' ' HIS . 24.9 mttm -139.14 27.21 2.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.849 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.597 ' CD2' ' N ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER 34.71 38.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.287 0.565 . . . . 0.0 110.328 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 30' ' ' LYS . . . -83.7 176.75 8.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.814 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -92.81 -27.62 17.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.8 p 177.96 -165.08 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.497 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.77 -176.88 47.58 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.476 -179.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -175.49 157.57 2.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.882 0.372 . . . . 0.0 110.962 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -90.7 104.38 16.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.603 -179.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -96.19 171.54 8.54 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.53 ' O ' ' O ' ' A' ' 40' ' ' ASP . 3.5 m-85 -99.11 -8.84 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.626 0.251 . . . . 0.0 111.039 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.565 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.4 OUTLIER 50.43 161.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.0 111.276 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -63.98 8.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.094 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.565 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -105.35 -23.72 12.8 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-O 120.9 0.381 . . . . 0.0 110.578 -179.982 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 66.29 52.2 1.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.665 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -139.24 12.22 2.59 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.825 0.345 . . . . 0.0 111.492 -179.641 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.7 tp 64.79 122.36 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -143.19 155.05 44.45 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.832 179.228 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 98.7 m -98.47 113.13 25.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.981 0.42 . . . . 0.0 112.016 -179.136 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -91.8 117.01 34.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.569 179.607 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.9 m -94.95 112.15 23.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -94.85 154.21 17.35 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.971 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -131.04 -22.34 2.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.438 -179.017 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.543 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -139.13 -64.64 0.5 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.724 0.297 . . . . 0.0 110.948 -179.439 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.543 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 9.4 tt0 88.17 -9.97 0.51 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.109 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.464 ' CD1' ' O ' ' A' ' 53' ' ' GLU . 46.3 m-85 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.978 179.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 CA-C-O 120.8 0.333 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.409 ' CG ' ' O ' ' A' ' 2' ' ' ASP . 14.5 p-10 -89.96 70.17 7.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.716 179.99 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.407 ' C ' ' H ' ' A' ' 5' ' ' LYS . 0.5 OUTLIER -108.29 93.1 4.35 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.044 0.45 . . . . 0.0 111.213 -179.797 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.64 11.89 1.89 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.671 179.426 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.407 ' H ' ' C ' ' A' ' 3' ' ' LYS . 32.7 mttt -97.23 121.45 39.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.889 179.859 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.405 ' HB3' ' HZ1' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -136.73 126.1 24.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.064 0.459 . . . . 0.0 111.144 -179.984 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.5 m -62.36 149.52 9.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.014 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' O ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -51.01 -103.44 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.7 179.19 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 178.13 -14.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.378 -0.201 . . . . 0.0 111.484 179.445 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -178.01 21.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.326 . . . . 0.0 110.996 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.491 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 49.8 t80 -56.01 113.54 5.96 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.02 99.23 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.077 1.851 . . . . 0.0 112.256 179.926 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -53.7 92.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.39 179.759 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.556 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 0.6 OUTLIER -175.46 128.5 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.797 -179.702 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 14' ' ' SER . 2.9 tptt 92.62 -13.35 0.17 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.631 -179.82 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m -66.56 70.61 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.728 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' A' ' 15' ' ' LYS . 10.3 mp0 -114.43 -15.62 12.05 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.376 -179.734 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.434 ' O ' ' O ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -162.11 176.27 10.87 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.93 0.395 . . . . 0.0 110.349 -179.843 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -56.7 -149.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.639 -179.837 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 61.55 -79.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.262 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.491 ' OE1' ' OH ' ' A' ' 11' ' ' TYR . 7.8 tp-100 -41.18 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.153 -179.645 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 t -59.36 -41.89 90.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.22 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.21 -74.16 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.009 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.539 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -49.33 -40.12 34.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.529 179.92 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 7.7 m-20 -55.64 -65.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.137 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.9 m -56.33 -35.93 68.17 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.906 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttpp -59.86 2.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.93 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 26' ' ' CYS . 13.2 tp -165.14 -36.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.0 m-20 -67.86 -14.17 62.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -141.38 16.9 2.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.756 179.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.4 m80 53.2 29.11 7.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.62 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.46 -175.61 5.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.634 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -98.41 -50.34 4.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 -179.82 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.0 OUTLIER -141.43 -173.58 3.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.323 179.595 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.457 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . -168.21 166.38 39.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.063 -1.065 . . . . 0.0 113.363 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -177.2 146.68 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.05 138.43 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.993 0.425 . . . . 0.0 111.527 -179.453 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.19 158.1 43.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.644 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.563 ' CE2' ' CD2' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -81.93 155.26 25.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.839 179.77 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.55 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 4.6 p-10 -161.5 58.62 0.28 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.832 0.348 . . . . 0.0 111.688 -179.885 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 19.1 tp10 93.34 -16.86 0.12 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.47 -0.787 . . . . 0.0 111.579 178.685 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.61 -7.53 34.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.234 -179.221 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? 40.11 39.87 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.236 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -143.64 5.58 1.4 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.563 ' CD2' ' CE2' ' A' ' 39' ' ' TYR . 1.0 OUTLIER 71.65 152.67 0.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.192 179.441 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -149.09 137.4 20.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.163 179.483 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 98.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 43.0 mm -89.82 113.29 25.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.2 m -92.36 129.84 38.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.079 0.466 . . . . 0.0 111.231 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -96.13 125.17 40.47 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.689 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -98.92 -27.44 13.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.752 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.8 m -101.03 -107.81 0.23 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.184 0.516 . . . . 0.0 110.867 179.741 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.579 ' CG ' ' H ' ' A' ' 54' ' ' TYR . 4.1 tp10 -168.3 -137.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.176 179.988 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.579 ' H ' ' CG ' ' A' ' 53' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.189 -0.91 . . . . 0.0 110.137 179.676 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.58 0 CA-C-O 120.829 0.347 . . . . 0.0 111.347 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.43 ' O ' ' C ' ' A' ' 3' ' ' LYS . 53.8 t0 -166.64 -61.03 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.746 179.838 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.575 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 30.5 mmtt -37.13 122.46 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.59 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.575 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.3 m 158.66 -3.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.035 -179.424 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -87.7 143.29 27.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.312 0.577 . . . . 0.0 112.037 -178.782 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -147.88 122.16 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.922 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.74 149.89 5.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.477 ' N ' ' O ' ' A' ' 47' ' ' CYS . 0.3 OUTLIER -105.86 76.65 1.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.875 -1.057 . . . . 0.0 108.305 177.719 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 11' ' ' TYR . 1.6 pt-20 -47.63 -94.0 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.689 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -47.18 92.76 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.377 178.877 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.496 ' N ' ' O ' ' A' ' 9' ' ' GLU . 67.1 t80 -177.8 107.29 0.22 Allowed Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.05 -179.099 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.551 ' O ' ' N ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.57 124.36 8.05 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.351 2.034 . . . . 0.0 112.276 179.925 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.425 ' O ' ' CG1' ' A' ' 13' ' ' VAL . 40.8 t -60.57 45.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.938 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.551 ' N ' ' O ' ' A' ' 12' ' ' PRO . 78.5 p -63.3 -125.86 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.476 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -68.64 151.91 46.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.335 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.498 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -173.27 -32.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.205 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -74.19 38.93 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.608 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.498 ' H ' ' C ' ' A' ' 16' ' ' CYS . 27.4 mt -161.91 -102.58 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.828 -179.639 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -179.62 -153.69 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.415 -179.443 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.74 -82.49 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.417 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.481 ' CA ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -33.82 -76.46 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.475 -179.979 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.91 -52.34 65.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.244 0.545 . . . . 0.0 110.661 179.242 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -78.25 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.32 -179.623 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -44.87 -48.98 11.15 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.832 -179.361 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 29' ' ' ASP . 5.0 m-20 -52.88 -65.77 0.5 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.442 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.513 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -57.34 -29.9 64.37 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.52 -179.854 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.84 1.54 0.14 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.071 179.131 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.513 ' H ' ' C ' ' A' ' 26' ' ' CYS . 23.6 tp -162.44 -31.73 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.391 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 25' ' ' ASP . 66.5 m-20 -68.63 -17.56 64.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.202 0.525 . . . . 0.0 110.019 179.448 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -141.93 -1.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.54 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.3 m80 63.73 42.15 6.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.791 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.03 -173.62 4.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 8.1 ttp180 -98.99 -56.5 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.999 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 48.4 p -167.55 135.34 2.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.038 -179.931 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -123.28 -165.13 12.25 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.42 -0.895 . . . . 0.0 114.983 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -176.14 -145.77 0.02 OUTLIER 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.16 -1.02 . . . . 0.0 109.118 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.17 137.55 20.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.655 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.537 ' CD2' ' CD1' ' A' ' 48' ' ' ILE . 19.6 m-85 -142.21 157.07 45.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.304 178.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.532 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 17.2 m-85 -72.08 169.3 16.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.433 -179.582 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -162.9 -158.94 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.436 -179.488 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -62.88 -11.26 17.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.828 -179.36 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.622 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -94.62 10.15 35.96 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.084 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 52.33 2.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.983 0.421 . . . . 0.0 111.144 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.622 ' H ' ' C ' ' A' ' 42' ' ' LYS . 4.0 m120 -100.88 -136.04 0.31 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.619 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.459 ' N ' ' CD2' ' A' ' 45' ' ' LEU . 0.2 OUTLIER -152.39 118.47 5.5 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.317 0.579 . . . . 0.0 111.183 179.053 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -97.26 152.03 19.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.548 -179.601 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -78.18 113.38 16.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.665 179.617 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.537 ' CD1' ' CD2' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -101.31 113.0 36.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.739 -179.693 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.3 m -99.11 134.56 41.78 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.338 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.2 t70 -95.2 115.81 27.92 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.849 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -103.43 57.0 0.74 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.648 -179.224 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.84 21.6 9.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.158 -179.531 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -77.11 4.04 11.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.149 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.741 179.9 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.53 0 CA-C-O 120.822 0.344 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -177.86 -159.66 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.808 -179.807 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.1 mttt 71.15 150.98 0.1 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.948 0.404 . . . . 0.0 111.294 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m 51.34 48.59 22.7 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.24 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.05 155.99 43.16 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.791 179.275 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -151.01 110.24 3.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.017 0.437 . . . . 0.0 111.198 -179.698 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.6 m -66.45 144.84 14.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.239 179.876 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.553 ' O ' ' CG ' ' A' ' 9' ' ' GLU . 1.9 t80 -63.13 -75.52 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.484 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.58 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.3 pp20? 104.26 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 O-C-N 124.649 1.218 . . . . 0.0 112.074 178.466 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.58 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 10.4 t-20 107.89 -12.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.346 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.413 ' HH ' ' HG3' ' A' ' 21' ' ' GLN . 48.4 t80 -52.92 113.49 4.65 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.847 -179.941 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -42.73 112.48 0.27 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.014 1.81 . . . . 0.0 112.101 179.812 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.507 ' O ' ' C ' ' A' ' 14' ' ' SER . 69.4 t -52.7 -70.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.507 ' C ' ' O ' ' A' ' 13' ' ' VAL . 20.6 p 21.28 -95.04 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.669 179.974 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -69.82 108.95 4.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.477 179.667 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.27 57.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -141.54 22.46 2.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.82 179.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -167.81 125.87 1.21 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.53 179.947 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.24 99.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.627 -179.785 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.495 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.5 OUTLIER -175.98 -68.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.603 179.293 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.416 ' C ' HE21 ' A' ' 21' ' ' GLN . 2.8 tp60 -47.99 -74.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.873 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.8 t -58.52 -40.52 83.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.181 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -53.49 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 -179.674 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.554 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.37 -45.39 62.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.344 179.998 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.439 ' O ' ' N ' ' A' ' 29' ' ' ASP . 0.6 OUTLIER -50.55 -64.48 0.8 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.835 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.483 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.2 m -54.45 -33.61 59.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -61.89 3.37 0.16 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.591 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.483 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.9 OUTLIER -164.35 -27.26 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.531 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.4 m-20 -70.02 -29.67 66.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.789 0.328 . . . . 0.0 110.993 -179.899 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.482 ' O ' ' OH ' ' A' ' 51' ' ' TYR . 1.8 mtmp? -141.66 40.88 1.71 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.957 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.448 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.4 m80 31.73 44.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.363 179.864 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.12 179.27 6.17 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.92 0.39 . . . . 0.0 111.244 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.409 HH11 ' HG3' ' A' ' 33' ' ' ARG . 34.9 ttm-85 -96.15 -20.31 18.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.984 179.406 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.502 ' OG ' ' OE2' ' A' ' 53' ' ' GLU . 2.0 p 177.84 -176.24 0.18 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.241 179.783 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.6 167.87 36.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.796 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -177.24 157.21 1.32 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.805 0.336 . . . . 0.0 110.44 179.766 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -89.53 106.16 18.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.43 -179.369 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -107.96 151.28 26.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.897 179.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -81.13 177.17 9.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.935 0.398 . . . . 0.0 111.592 -179.76 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 42' ' ' LYS . 1.4 p30 -167.94 95.24 0.42 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.01 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' A' ' 40' ' ' ASP . 14.4 tt0 27.02 32.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.263 -179.908 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.641 ' N ' ' O ' ' A' ' 40' ' ' ASP . 16.9 mtpp -147.19 0.76 0.72 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.24 179.815 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 61.89 0.98 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.022 0.439 . . . . 0.0 110.283 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.59 ' ND2' ' O ' ' A' ' 42' ' ' LYS . 1.9 m120 -92.94 133.35 36.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.152 179.456 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.44 117.49 25.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.569 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -100.63 141.45 33.48 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.086 178.653 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.88 94.26 1.41 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.96 0.409 . . . . 0.0 111.42 -179.682 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.8 mt -90.13 120.32 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.562 179.58 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.4 m -92.75 114.97 27.68 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 178.927 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.69 135.49 33.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.978 0.418 . . . . 0.0 111.246 -179.254 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.482 ' OH ' ' O ' ' A' ' 30' ' ' LYS . 10.7 m-85 -109.66 -21.84 12.23 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.047 -178.891 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.517 ' O ' ' N ' ' A' ' 54' ' ' TYR . 2.4 m -140.27 -34.58 0.53 Allowed 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.828 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.59 ' O ' ' CD2' ' A' ' 54' ' ' TYR . 2.5 pt-20 34.44 -94.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.915 0.388 . . . . 0.0 110.281 -178.848 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.59 ' CD2' ' O ' ' A' ' 53' ' ' GLU . 7.9 m-85 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.68 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 CA-C-O 120.79 0.329 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -132.74 -122.31 0.19 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.593 179.962 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' A' ' 5' ' ' LYS . 18.4 mtmt 60.34 80.39 0.21 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.436 179.828 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER 67.01 -34.62 0.23 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.245 179.076 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.488 ' H ' ' C ' ' A' ' 3' ' ' LYS . 17.9 pttm -96.48 132.86 41.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.16 0.505 . . . . 0.0 111.906 -179.227 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -146.83 134.79 21.41 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.76 179.908 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.478 ' O ' ' OE2' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -65.2 154.75 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.441 -179.919 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.475 ' OH ' ' OD2' ' A' ' 29' ' ' ASP . 1.0 OUTLIER -92.68 85.06 5.13 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.397 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.544 ' O ' ' C ' ' A' ' 10' ' ' ASN . 1.0 OUTLIER -58.1 171.6 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 -178.917 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.544 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 16.02 101.09 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.599 0.562 . . . . 0.0 111.568 -179.389 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.5 OUTLIER 175.91 141.13 0.21 Allowed Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.037 -178.92 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.4 ' HB3' ' HZ3' ' A' ' 15' ' ' LYS . 56.8 Cg_exo -34.03 80.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.948 2.432 . . . . 0.0 113.07 -179.604 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.62 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.8 p -60.23 -27.06 38.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.448 179.841 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.42 -45.93 90.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.329 -179.39 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.4 ' HZ3' ' HB3' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -65.42 82.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.04 0.448 . . . . 0.0 110.614 -179.782 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -173.64 95.08 0.1 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 179.867 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.43 -34.15 3.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.933 179.552 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.0 mt -164.69 -175.21 3.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.304 179.852 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.559 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -53.82 177.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.376 -179.963 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 19' ' ' ALA . 0.2 OUTLIER 96.93 -85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.778 179.697 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -50.82 -70.04 0.1 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.699 0.285 . . . . 0.0 111.66 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.558 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.3 t -53.93 -45.15 71.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.17 -179.481 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -55.47 -66.9 0.34 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.061 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.55 -47.44 57.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.817 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.454 ' O ' ' C ' ' A' ' 28' ' ' LEU . 2.2 m-20 -52.67 -51.11 61.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.555 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.675 ' C ' ' H ' ' A' ' 28' ' ' LEU . 87.4 m -57.88 -40.79 81.07 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.585 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -57.46 -0.45 0.06 Allowed 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 177.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.683 ' C ' ' H ' ' A' ' 30' ' ' LYS . 10.1 tp -162.96 -139.39 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.202 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.475 ' OD2' ' OH ' ' A' ' 8' ' ' TYR . 3.7 m-20 65.24 -50.39 0.36 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 -177.16 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.683 ' H ' ' C ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -126.06 -85.97 0.62 Allowed 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.389 175.772 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.578 ' CD2' ' O ' ' A' ' 30' ' ' LYS . 1.3 p80 169.13 54.16 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.41 178.053 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.05 179.73 6.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.799 179.468 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.28 -33.46 12.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.184 0.516 . . . . 0.0 110.482 -179.991 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.421 ' OG ' ' CD ' ' A' ' 53' ' ' GLU . 13.6 p -166.42 -162.57 0.53 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.569 -0.742 . . . . 0.0 109.811 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 177.72 -168.58 40.16 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 119.693 -1.242 . . . . 0.0 113.471 179.847 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.558 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.7 OUTLIER -177.06 -158.54 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -179.921 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.32 144.79 26.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 111.508 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.449 ' O ' ' N ' ' A' ' 46' ' ' GLN . 57.5 m-85 -144.77 159.97 42.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.198 -179.705 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.596 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 3.1 m-85 -84.44 173.97 10.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.683 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -153.85 -171.4 3.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.929 0.395 . . . . 0.0 111.133 -179.769 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -12.93 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.533 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' ' C ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -95.04 25.88 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.887 -179.912 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 29.55 55.2 0.13 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.192 179.566 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 75.6 m-20 -141.8 -125.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.704 179.701 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.543 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -148.78 162.43 39.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.318 . . . . 0.0 110.592 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 38' ' ' PHE . 20.1 mt-30 -148.3 114.57 5.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.704 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -68.52 102.95 1.56 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.453 -179.513 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.6 mm -89.09 114.89 27.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.06 179.304 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.8 m -98.0 119.21 36.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.988 0.423 . . . . 0.0 110.894 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.13 130.02 44.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.176 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -95.56 -21.67 18.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.963 -179.613 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.495 ' O ' ' N ' ' A' ' 54' ' ' TYR . 16.6 m -97.4 -78.65 0.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.947 -179.752 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.421 ' CD ' ' OG ' ' A' ' 34' ' ' SER . 34.7 tt0 59.0 -77.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.866 -179.806 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 52' ' ' CYS . 44.0 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.799 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 120.824 0.345 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.474 ' O ' ' O ' ' A' ' 3' ' ' LYS . 3.0 p-10 -130.2 -169.76 2.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.89 -179.973 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.474 ' O ' ' O ' ' A' ' 2' ' ' ASP . 32.8 mttp -51.71 -107.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.648 179.842 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m -172.85 -1.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.934 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.34 148.73 40.17 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.915 0.388 . . . . 0.0 110.355 179.71 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -150.36 125.56 10.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.881 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -65.58 150.13 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-O 120.837 0.351 . . . . 0.0 111.063 179.768 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.503 ' O ' ' O ' ' A' ' 9' ' ' GLU . 30.2 t80 -100.19 -10.92 20.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.214 0.531 . . . . 0.0 110.888 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.563 ' O ' ' C ' ' A' ' 10' ' ' ASN . 2.0 pm0 34.31 -158.04 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.64 -179.576 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.563 ' C ' ' O ' ' A' ' 9' ' ' GLU . 37.2 t-20 2.42 102.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.671 0.607 . . . . 0.0 111.863 -179.719 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.3 OUTLIER 179.97 141.13 0.32 Allowed Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.561 -179.197 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -40.03 90.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.232 1.955 . . . . 0.0 112.409 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.639 ' O ' ' N ' ' A' ' 15' ' ' LYS . 54.7 t -52.87 -90.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.361 179.863 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.496 ' C ' ' O ' ' A' ' 13' ' ' VAL . 60.7 p 9.96 -70.21 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.864 0.728 . . . . 0.0 112.866 179.206 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -60.28 89.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.997 -179.546 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 116.92 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.356 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -114.15 -54.16 2.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.569 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.4 mt -174.2 -20.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.918 179.467 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 178.7 104.24 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.631 -179.693 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.562 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.4 OUTLIER -175.64 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.163 179.709 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.439 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 30.7 mm100 -50.71 -52.05 43.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.802 -179.772 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.65 -59.29 5.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 179.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.525 ' C ' HD21 ' A' ' 23' ' ' ASN . 0.1 OUTLIER -49.8 -63.68 1.04 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.57 -179.833 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -48.7 69.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.312 179.564 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.49 ' O ' ' N ' ' A' ' 29' ' ' ASP . 23.7 m-20 -49.24 -65.14 0.62 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.5 179.816 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.592 ' C ' ' H ' ' A' ' 28' ' ' LEU . 62.7 m -49.93 -41.99 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.326 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -61.0 10.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.659 179.169 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.592 ' H ' ' C ' ' A' ' 26' ' ' CYS . 11.3 tp -163.14 -30.1 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.684 0.278 . . . . 0.0 111.711 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.49 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -70.0 -61.35 1.81 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.345 179.776 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.84 19.17 14.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 53.2 32.94 14.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 -179.31 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.28 -177.35 6.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.784 -179.431 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.0 -42.06 8.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.767 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.3 p -154.85 -156.44 0.67 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.842 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 171.2 -175.91 44.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.569 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -177.78 155.82 1.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.459 ' SG ' ' O ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -87.43 155.48 20.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.876 0.369 . . . . 0.0 110.899 179.99 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -146.65 121.13 9.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.808 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.634 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 34.8 m-85 -70.87 -93.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.245 179.555 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.54 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER 53.94 147.65 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.499 0.666 . . . . 0.0 111.694 179.409 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.54 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 2.6 tt0 89.62 -79.22 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.728 178.299 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.63 73.65 1.19 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.201 -178.792 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.58 38.78 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.296 179.314 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.634 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 54.1 m-80 -92.77 -163.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.132 179.76 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 9.2 mt -155.23 98.22 1.98 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.786 0.327 . . . . 0.0 111.266 179.984 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.459 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 78.1 mt-30 -94.79 170.51 9.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.018 179.148 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.8 109.46 15.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.042 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mm -92.68 121.62 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.55 179.367 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.93 122.58 43.07 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.647 0.26 . . . . 0.0 110.63 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.85 141.63 28.29 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.91 0.386 . . . . 0.0 110.63 -179.996 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -114.75 -12.83 12.1 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.907 -179.102 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -137.21 4.94 2.73 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.624 0.25 . . . . 0.0 111.374 -179.388 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.454 ' O ' ' C ' ' A' ' 54' ' ' TYR . 4.9 tt0 40.38 66.55 0.6 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.056 0.455 . . . . 0.0 110.653 179.913 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.454 ' C ' ' O ' ' A' ' 53' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.691 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 120.845 0.355 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -46.93 -57.45 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.148 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 mttm -91.25 153.28 20.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.47 -179.586 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER 173.4 -75.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.962 179.388 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -95.42 135.92 36.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 113.83 7.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.998 0.427 . . . . 0.0 111.331 -179.434 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -65.3 135.93 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.458 179.228 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.583 ' C ' ' H ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -64.82 106.61 1.25 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.902 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 10' ' ' ASN . 8.5 mt-10 -63.06 43.16 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.324 -178.785 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.583 ' H ' ' C ' ' A' ' 8' ' ' TYR . 1.3 m120 172.42 -97.75 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.561 179.878 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.519 ' C ' ' O ' ' A' ' 10' ' ' ASN . 8.2 t80 8.52 76.37 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.423 0 O-C-N 123.733 0.645 . . . . 0.0 112.63 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.542 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.6 Cg_exo -62.66 109.66 0.94 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.985 2.457 . . . . 0.0 112.026 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.555 ' O ' ' CB ' ' A' ' 14' ' ' SER . 21.6 t 8.75 -108.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 O-C-N 123.845 0.716 . . . . 0.0 112.039 179.946 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 13' ' ' VAL . 5.1 p 91.33 -45.15 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.754 0.312 . . . . 0.0 111.457 179.124 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -172.56 74.94 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.977 0.418 . . . . 0.0 110.874 -178.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -66.44 -59.9 3.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.893 -179.689 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.596 ' O ' ' N ' ' A' ' 19' ' ' ALA . 0.9 OUTLIER 61.5 10.81 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.738 179.207 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.432 ' C ' ' O ' ' A' ' 17' ' ' GLN . 6.5 mp 30.79 30.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' A' ' 17' ' ' GLN . . . 175.99 35.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.732 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER -166.47 -141.29 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.518 179.537 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.548 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER 2.62 -69.37 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 124.008 0.817 . . . . 0.0 111.981 179.721 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.586 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.1 t -58.94 -65.71 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.023 179.57 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' ASN . 44.4 t-20 -51.29 -54.81 22.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.958 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -54.33 -44.63 72.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.137 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 78.6 m-20 -57.28 -64.79 0.77 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.219 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.507 ' C ' ' H ' ' A' ' 28' ' ' LEU . 58.1 m -52.78 -51.46 60.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.742 179.846 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -59.72 10.55 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.816 -179.799 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.507 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.82 -52.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 119.998 -0.681 . . . . 0.0 112.72 -179.495 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.5 OUTLIER -66.72 -7.57 21.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.578 0.228 . . . . 0.0 111.474 -179.12 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.46 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -141.81 24.84 2.01 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.952 0.406 . . . . 0.0 110.378 179.448 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.7 m80 38.46 38.91 0.27 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.037 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.16 -176.35 5.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.827 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -95.85 -45.27 7.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.384 179.825 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.474 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 2.7 p -168.93 130.96 1.24 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.92 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -101.98 174.88 24.71 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.33 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -174.92 138.31 0.46 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.982 0.42 . . . . 0.0 110.583 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.2 m -89.48 113.12 24.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.416 -179.453 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -97.98 141.54 30.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.423 179.297 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.494 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 9.5 m-85 -83.26 -169.67 2.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.936 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.562 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 2.9 p-10 -173.59 156.03 2.87 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.346 0.593 . . . . 0.0 112.04 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.464 ' C ' ' O ' ' A' ' 40' ' ' ASP . 21.9 mt-10 16.92 -82.27 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.103 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.9 mptt -91.64 60.87 4.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.232 0.539 . . . . 0.0 110.943 -178.917 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.467 ' C ' ' O ' ' A' ' 42' ' ' LYS . 28.3 mmt180 29.04 60.44 0.14 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.584 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.494 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.6 OUTLIER -95.39 -154.53 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.792 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.7 mp -155.23 140.73 17.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.844 0.354 . . . . 0.0 110.995 179.545 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -143.05 131.81 22.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.252 179.834 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.66 101.73 4.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.358 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.7 mt -95.84 114.31 32.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.474 178.194 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.46 ' SG ' ' NZ ' ' A' ' 30' ' ' LYS . 91.7 m -94.73 118.8 32.32 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.301 179.364 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.1 t0 -94.45 118.3 31.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.452 0.644 . . . . 0.0 111.212 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -99.21 -89.65 0.31 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.029 179.6 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.4 m 62.45 26.22 15.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.032 179.53 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -125.07 -0.12 7.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.473 179.569 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.196 -0.906 . . . . 0.0 110.896 179.819 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.554 0 CA-C-O 120.897 0.38 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -69.41 50.08 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.952 179.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.9 mmtt -84.7 125.3 32.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.844 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.01 -12.22 60.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.752 179.934 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.92 97.01 3.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.411 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.4 mttt -93.72 107.22 19.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.897 0.38 . . . . 0.0 111.36 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.1 m -66.55 130.7 32.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.719 179.873 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.546 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -74.27 58.58 0.73 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.069 0.461 . . . . 0.0 110.442 179.504 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.567 ' O ' ' N ' ' A' ' 11' ' ' TYR . 7.1 mt-10 26.2 -153.61 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.442 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -60.16 56.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.611 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.567 ' N ' ' O ' ' A' ' 9' ' ' GLU . 42.8 t80 -50.69 140.97 18.41 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.414 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' A' ' 11' ' ' TYR . 17.0 Cg_endo -57.29 92.48 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 -179.68 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.0 t -53.88 105.88 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.185 -179.622 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 p -176.33 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.05 179.98 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.571 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 16.2 mmmt -66.02 136.39 55.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.108 179.169 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.571 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.5 m -170.11 -64.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.616 0.246 . . . . 0.0 111.492 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.477 ' C ' ' O ' ' A' ' 16' ' ' CYS . 1.7 mm-40 -28.14 -38.8 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.408 -179.478 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 16' ' ' CYS . 1.1 mp -70.65 -120.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.19 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.45 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -179.65 -20.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.248 0.547 . . . . 0.0 111.631 -179.736 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.479 ' O ' ' C ' ' A' ' 21' ' ' GLN . 1.2 t-20 -47.62 -106.38 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.847 -178.93 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.479 ' C ' ' O ' ' A' ' 20' ' ' ASN . 13.7 mm-40 -25.26 -60.22 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.309 -179.131 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -54.04 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.937 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 2.5 t-20 -48.73 -54.83 13.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.901 -179.324 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -52.29 -55.83 18.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.648 179.907 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 96.8 m-20 -50.74 -55.16 17.99 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.262 -179.619 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.535 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.0 m -54.85 -45.9 74.61 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.938 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -61.44 11.84 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.531 -0.758 . . . . 0.0 112.223 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.535 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.7 tt -165.02 -47.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.294 -0.562 . . . . 0.0 112.261 -179.469 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 92.4 m-20 -66.7 -11.27 53.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.133 0.492 . . . . 0.0 110.169 179.789 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.427 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 36.0 mmtm -141.72 5.37 1.77 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.038 179.427 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.427 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 41.17 46.05 2.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.737 -179.866 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.32 -173.7 4.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.917 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.12 -23.59 18.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.291 0.567 . . . . 0.0 109.698 179.541 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -177.64 -168.44 0.18 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.993 179.702 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.468 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . 166.95 170.26 31.6 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.929 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -179.31 -179.97 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.732 0.301 . . . . 0.0 110.259 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 39.1 m -88.61 88.82 7.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.266 179.391 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -91.72 159.06 16.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.834 -179.734 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.565 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 5.0 m-85 -83.77 166.26 18.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.008 179.926 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 6.3 p-10 -129.19 -173.15 2.91 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.047 -179.532 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.52 2.06 0.19 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.29 -179.656 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.53 ' O ' ' CD ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -95.61 -63.89 1.11 Allowed 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.391 179.777 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.53 ' CD ' ' O ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 139.78 5.08 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.225 1.41 . . . . 0.0 109.734 179.397 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.565 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.4 OUTLIER -90.96 -140.63 0.16 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.882 0.372 . . . . 0.0 111.302 -179.518 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.53 ' CD2' ' CZ ' ' A' ' 39' ' ' TYR . 0.2 OUTLIER -147.32 149.16 32.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 -179.597 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.51 HE22 ' CG ' ' A' ' 40' ' ' ASP . 3.5 mp0 -148.83 136.78 20.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.674 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.424 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -66.18 87.19 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.768 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.7 mt -86.57 124.07 40.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.047 0.451 . . . . 0.0 111.627 -179.803 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.7 m -93.12 110.68 22.18 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.202 178.442 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.62 130.5 37.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.37 0.605 . . . . 0.0 112.084 -178.509 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -100.01 -42.04 6.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.24 179.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.7 50.13 0.78 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.296 -179.473 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -73.7 93.36 2.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.891 0.376 . . . . 0.0 110.691 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.061 -179.821 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 CA-C-O 120.726 0.298 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.543 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 3.3 p-10 -156.45 152.18 27.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.016 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -67.79 164.4 19.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.033 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.417 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.8 m -152.65 45.87 0.71 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.241 -179.596 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 138.32 24.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.743 0.306 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -143.76 114.65 7.76 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.539 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.417 ' O ' ' CG2' ' A' ' 7' ' ' VAL . 2.7 m -66.53 127.82 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.047 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -85.19 80.09 9.33 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.312 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -57.29 -70.38 0.13 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.398 0.618 . . . . 0.0 110.042 -179.003 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.403 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 60.0 t-20 -51.92 86.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.707 178.964 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.618 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.7 t80 -177.8 97.34 0.22 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.452 -179.027 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.537 ' O ' ' C ' ' A' ' 13' ' ' VAL . 79.8 Cg_exo -45.94 75.65 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.814 2.342 . . . . 0.0 112.978 -179.574 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.618 ' N ' ' O ' ' A' ' 11' ' ' TYR . 15.9 t -7.86 -62.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 O-C-N 123.798 0.686 . . . . 0.0 112.52 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.518 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 67.4 p 27.23 -92.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.481 -179.82 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.518 ' N ' ' OG ' ' A' ' 14' ' ' SER . 0.1 OUTLIER -68.9 156.49 38.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.54 -179.624 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 1.7 m -172.59 -37.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.73 52.04 1.39 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.298 0.571 . . . . 0.0 109.785 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.4 mt -161.95 96.24 1.0 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.282 -179.215 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.18 78.74 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.737 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.566 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER -162.01 -79.14 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.292 179.847 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.51 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -22.75 -86.16 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.347 179.844 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.487 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 1.9 m -57.55 -52.38 65.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.163 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.84 -75.18 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.573 -179.103 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.566 ' N ' ' O ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -48.94 -57.13 6.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.724 -179.077 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.493 ' O ' ' N ' ' A' ' 29' ' ' ASP . 34.6 m-20 -52.11 -56.44 14.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.336 -179.453 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.567 ' C ' ' H ' ' A' ' 28' ' ' LEU . 94.9 m -50.44 -53.06 32.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.029 0.442 . . . . 0.0 110.064 179.834 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -61.99 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.335 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.567 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.4 tt -163.68 -40.82 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -179.759 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.493 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -67.2 -40.07 86.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.754 0.312 . . . . 0.0 110.764 -179.707 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.55 ' CB ' ' HH ' ' A' ' 51' ' ' TYR . 4.6 mtpp -112.72 15.49 19.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.544 179.486 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.7 m170 52.04 44.37 29.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.852 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.61 -154.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.896 0.379 . . . . 0.0 111.121 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.2 mtp85 -142.52 -2.99 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.831 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.3 p -175.32 -179.83 1.38 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.728 -179.94 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 156.73 167.95 18.68 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.337 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -178.51 174.99 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.903 0.382 . . . . 0.0 110.901 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -86.54 133.9 33.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.1 179.661 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -144.98 148.6 33.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.057 0.456 . . . . 0.0 111.44 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -75.44 -179.73 4.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.456 -179.531 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.546 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -154.85 -179.86 8.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.072 179.9 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.4 0.62 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.946 0.403 . . . . 0.0 110.462 -179.979 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.546 ' H ' ' C ' ' A' ' 40' ' ' ASP . 25.4 mtmm -102.2 -12.65 17.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.164 -179.886 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.477 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 15.7 ttp180 83.16 -5.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -95.6 156.13 16.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.435 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.8 mp -91.44 157.4 17.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.037 0.446 . . . . 0.0 111.775 -179.568 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -146.03 143.7 29.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.786 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.2 m -79.34 97.96 6.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.7 mt -87.06 126.09 40.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.9 m -98.84 111.75 24.05 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.955 179.421 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -95.22 131.64 41.05 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.55 ' HH ' ' CB ' ' A' ' 30' ' ' LYS . 35.1 m-85 -103.98 -37.01 7.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.862 -179.281 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.536 ' O ' ' N ' ' A' ' 54' ' ' TYR . 1.4 m -144.0 -11.49 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.706 -178.819 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 60.44 -71.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 110.88 -179.479 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 52' ' ' CYS . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.683 179.992 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.582 0 CA-C-O 120.739 0.304 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -64.9 -42.61 94.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.47 179.883 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -159.11 120.34 3.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.216 179.796 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.24 11.41 0.4 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.925 179.821 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 116.27 8.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.504 179.535 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.616 ' NZ ' ' HH ' ' A' ' 51' ' ' TYR . 11.2 pttm -152.46 135.99 16.04 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.253 -0.579 . . . . 0.0 112.1 -178.977 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.55 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -67.23 150.85 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.582 179.228 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.674 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -64.28 61.6 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.462 179.813 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 7' ' ' VAL . 2.8 mt-10 16.76 -140.65 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.38 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.78 12.52 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -178.202 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.623 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 67.3 t80 -50.98 143.11 16.14 Favored Pre-proline 0 N--CA 1.467 0.387 0 O-C-N 121.952 -0.468 . . . . 0.0 109.786 179.597 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.583 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 9.4 Cg_endo -48.16 -88.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.876 1.717 . . . . 0.0 112.179 -179.596 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.64 ' C ' ' H ' ' A' ' 15' ' ' LYS . 71.0 t 117.47 -8.12 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.638 1.175 . . . . 0.0 110.728 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 p -66.28 25.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.24 179.69 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.64 ' H ' ' C ' ' A' ' 13' ' ' VAL . 0.6 OUTLIER -172.02 99.57 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.96 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -171.25 27.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.815 -179.097 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.513 ' N ' ' CD ' ' A' ' 17' ' ' GLN . 1.7 mm100 -76.16 17.23 0.36 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.768 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.436 ' H ' ' C ' ' A' ' 16' ' ' CYS . 7.1 mt -163.42 -90.29 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.972 -179.848 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.92 -150.97 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.147 0.499 . . . . 0.0 110.995 -179.082 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.552 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.1 OUTLIER 67.0 -75.47 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.914 179.899 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.552 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 4.8 tp-100 -38.13 -83.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 -179.667 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.623 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -57.68 -40.74 80.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 110.737 179.416 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.411 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -56.66 -76.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.865 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.28 -40.38 24.67 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.845 179.946 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' A' ' 29' ' ' ASP . 65.6 m-20 -55.04 -68.52 0.18 Allowed 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.055 -179.787 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.674 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -54.52 -39.33 67.51 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.793 179.824 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.413 ' HZ1' ' HA ' ' A' ' 24' ' ' TYR . 3.0 ttpm? -60.77 6.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.088 179.723 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.521 ' H ' ' C ' ' A' ' 26' ' ' CYS . 17.4 tp -163.38 -36.77 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.546 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 25' ' ' ASP . 11.5 m-20 -67.68 -13.34 62.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.068 0.461 . . . . 0.0 110.351 -179.918 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -141.31 8.85 2.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.074 179.398 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 56.8 50.69 12.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.959 179.925 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.85 173.8 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.764 179.83 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -93.39 -51.2 5.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.294 179.886 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.3 p -160.96 126.57 3.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 179.871 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.411 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . -132.15 167.57 22.86 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.878 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -176.76 161.18 2.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.358 0.599 . . . . 0.0 111.003 -179.885 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -86.94 128.32 35.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.764 -179.737 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -125.62 148.75 48.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.043 0.449 . . . . 0.0 111.109 -179.725 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.625 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 25.2 m-85 -99.26 152.6 19.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.131 179.444 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.48 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.3 OUTLIER -95.92 172.63 7.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.176 179.147 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -61.66 -2.02 0.71 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.035 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.48 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -97.59 -80.06 0.45 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.301 179.384 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.05 21.59 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.463 179.601 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.625 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -95.26 -165.1 1.24 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.767 0.318 . . . . 0.0 111.197 -179.964 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.406 ' CD1' ' CZ ' ' A' ' 39' ' ' TYR . 1.4 mt -146.22 147.06 31.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 0.0 111.057 -179.5 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -148.75 125.4 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 65.9 m -77.74 95.91 4.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.819 -179.92 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.3 mm -83.77 114.61 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.95 -179.428 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.5 m -106.04 111.84 24.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.317 178.984 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -96.82 153.85 17.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.064 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.616 ' HH ' ' NZ ' ' A' ' 6' ' ' LYS . 37.8 m-85 -121.06 -25.95 5.23 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.966 -178.889 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.2 m -93.55 -110.08 0.11 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.872 0.367 . . . . 0.0 111.245 -179.71 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -173.89 84.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.747 -179.473 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.775 -179.908 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.641 0 CA-C-O 120.867 0.365 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 0.3 OUTLIER -88.13 176.78 7.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.889 -179.875 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.22 127.59 7.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.293 179.96 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.406 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.2 m -155.24 33.63 0.38 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.144 0.497 . . . . 0.0 111.198 -179.606 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 tptm -98.43 132.06 44.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.536 179.686 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -149.26 117.42 6.39 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.887 0.375 . . . . 0.0 111.516 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.4 143.41 15.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.16 -179.908 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.478 ' CE1' ' NZ ' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -86.34 109.42 18.98 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.025 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.505 ' O ' ' O ' ' A' ' 10' ' ' ASN . 2.5 mt-10 -55.1 -174.79 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.477 -178.916 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.505 ' O ' ' O ' ' A' ' 9' ' ' GLU . 5.5 p30 17.57 104.6 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.855 0.722 . . . . 0.0 111.923 -179.575 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.533 ' C ' ' H ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -179.86 81.57 0.19 Allowed Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.272 -179.636 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.496 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 52.7 Cg_exo -56.79 5.93 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 123.235 2.624 . . . . 0.0 113.822 -178.793 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.533 ' H ' ' C ' ' A' ' 11' ' ' TYR . 90.7 t 101.87 -72.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.201 1.001 . . . . 0.0 111.505 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.491 ' C ' ' O ' ' A' ' 13' ' ' VAL . 7.0 p 27.72 89.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 14' ' ' SER . 1.0 OUTLIER 92.86 -123.63 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.426 -179.426 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER 78.94 -49.18 0.43 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.528 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.88 -12.88 8.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.082 0.468 . . . . 0.0 110.659 -179.568 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.576 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 0.8 OUTLIER -71.82 -45.08 62.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.094 179.885 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.576 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 101.98 3.86 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 O-C-N 123.773 0.67 . . . . 0.0 110.802 -179.619 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.595 ' O ' ' N ' ' A' ' 22' ' ' CYS . 5.3 t-20 -97.03 -118.24 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.744 179.81 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 20' ' ' ASN . 14.7 mm100 -1.14 -65.31 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.952 0.782 . . . . 0.0 112.326 179.677 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.4 t -57.11 -69.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.93 179.887 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.41 ' N ' ' O ' ' A' ' 20' ' ' ASN . 25.0 t30 -50.45 -51.06 50.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.27 179.933 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.49 -47.31 76.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.64 179.367 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.429 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 97.3 m-20 -57.19 -55.3 36.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.871 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.641 ' C ' ' H ' ' A' ' 28' ' ' LEU . 57.0 m -56.06 -47.57 77.68 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.869 179.724 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.86 8.83 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.112 178.902 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.673 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -162.79 -132.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.677 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.416 ' H ' HD12 ' A' ' 28' ' ' LEU . 1.6 m-20 39.85 -77.2 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.461 0.476 . . . . 0.0 111.897 -179.889 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.673 ' N ' ' O ' ' A' ' 28' ' ' LEU . 12.6 mttp -91.99 -4.91 53.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.719 0.295 . . . . 0.0 110.981 -179.769 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.526 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.6 OUTLIER 82.99 44.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.642 179.391 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.508 ' CB ' ' O ' ' A' ' 26' ' ' CYS . . . -88.0 172.7 9.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.26 179.276 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -95.73 -29.25 14.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.009 0.433 . . . . 0.0 110.49 179.921 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.7 p -174.54 -164.67 0.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.653 179.882 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 168.54 -178.5 42.01 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.348 -179.909 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -178.22 160.7 1.38 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.868 0.366 . . . . 0.0 110.622 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 137.27 32.48 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.566 -179.81 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -146.39 131.78 18.61 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.147 0.499 . . . . 0.0 112.202 -179.405 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.535 ' CZ ' ' O ' ' A' ' 43' ' ' ARG . 1.2 m-85 -39.04 163.51 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.598 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 44' ' ' ASN . 19.5 p30 -136.87 -161.76 1.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.192 179.504 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -63.1 -28.33 70.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.146 -179.664 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 24.0 mmmt -99.67 28.17 4.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.186 -179.794 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.535 ' O ' ' CZ ' ' A' ' 39' ' ' TYR . 28.8 mtm180 59.74 5.8 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.433 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 73.2 m-80 -94.96 145.94 24.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.968 0.413 . . . . 0.0 111.215 -179.7 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.444 ' CD2' ' H ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -91.34 120.79 32.52 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -178.622 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -98.61 148.57 23.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.542 178.306 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -78.58 98.14 6.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.629 -179.383 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.4 mt -87.83 116.73 30.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.25 179.397 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.6 m -96.52 120.89 37.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 179.924 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -97.25 134.59 40.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.359 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -104.65 -28.43 11.23 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.667 -178.943 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.406 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m -144.75 67.73 1.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 0.0 111.384 -179.495 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.446 ' O ' ' C ' ' A' ' 54' ' ' TYR . 2.6 tp10 50.51 -95.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.954 179.595 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.446 ' C ' ' O ' ' A' ' 53' ' ' GLU . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.959 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.611 0 CA-C-O 120.823 0.344 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.406 ' O ' ' O ' ' A' ' 3' ' ' LYS . 72.6 m-20 -149.23 -81.25 0.12 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.041 -179.775 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.406 ' O ' ' O ' ' A' ' 2' ' ' ASP . 7.6 tmtt? 50.37 101.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.731 -179.859 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 172.39 24.86 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.044 -179.396 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.481 ' N ' ' CD ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -140.47 151.14 44.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.939 0.4 . . . . 0.0 111.8 -179.363 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -148.89 133.75 17.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.504 -179.771 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.8 m -65.66 139.75 20.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.649 179.778 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.474 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -81.51 54.33 2.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.859 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.609 ' O ' ' N ' ' A' ' 11' ' ' TYR . 13.1 mt-10 25.22 -145.59 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.784 -179.968 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -57.62 58.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.104 -179.51 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.609 ' N ' ' O ' ' A' ' 9' ' ' GLU . 35.4 t80 -56.19 121.33 41.16 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 110.513 -0.18 . . . . 0.0 110.513 179.424 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -41.02 90.12 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.547 1.498 . . . . 0.0 111.292 179.096 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.537 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -51.45 95.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.222 0.534 . . . . 0.0 111.11 -179.276 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 91.0 p -175.25 130.66 0.29 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.54 -179.903 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.498 ' O ' ' C ' ' A' ' 16' ' ' CYS . 26.8 mttt 87.96 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.764 0.665 . . . . 0.0 110.919 -179.537 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.498 ' C ' ' O ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER 25.2 98.01 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.344 0.403 . . . . 0.0 111.282 179.953 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.426 ' O ' ' C ' ' A' ' 18' ' ' LEU . 31.7 mt-30 -120.65 50.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 -179.981 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.573 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 26.1 mt 36.5 89.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.909 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.573 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 103.28 149.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 124.107 0.879 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.608 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.2 OUTLIER 84.46 -68.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 179.547 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.608 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 6.7 mm-40 -49.43 -79.06 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.672 0.272 . . . . 0.0 111.011 -179.542 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.1 m -55.23 -39.17 69.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.916 0.388 . . . . 0.0 110.52 179.956 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -55.65 -81.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.594 179.45 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.72 -46.8 30.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.232 -179.855 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.444 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 3.6 m-20 -51.82 -66.53 0.37 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.461 0.172 . . . . 0.0 110.93 -179.66 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.574 ' C ' ' H ' ' A' ' 28' ' ' LEU . 28.8 m -55.36 -36.54 66.44 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.384 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -60.48 6.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.17 179.297 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.574 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.5 tp -159.64 -34.16 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.288 -179.384 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 25' ' ' ASP . 36.0 m-20 -70.61 -56.82 5.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.004 0.43 . . . . 0.0 110.111 179.293 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 2.1 mptt -102.61 21.3 15.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.336 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.4 p80 35.43 45.17 0.21 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.154 0.502 . . . . 0.0 110.796 -179.943 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.09 -132.79 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.608 179.798 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -139.32 -31.12 0.7 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.294 179.382 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.2 p -167.33 -164.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.796 -179.931 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.09 -171.31 44.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -177.15 154.33 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.852 0.358 . . . . 0.0 110.983 -179.969 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 92.2 m -85.52 96.71 9.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.566 179.976 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -108.12 163.0 13.54 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.194 -179.872 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.506 ' O ' ' O ' ' A' ' 40' ' ' ASP . 27.5 m-85 -87.03 -22.77 25.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.769 179.745 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.529 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER 48.0 171.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.803 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.74 39.58 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.469 -179.681 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' A' ' 40' ' ' ASP . 16.2 mtmt -144.64 -1.76 0.88 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.563 -179.666 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 41.76 65.91 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.233 0.539 . . . . 0.0 109.934 -179.515 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -138.94 0.97 2.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.325 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.1 tm? 51.63 63.86 2.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.012 0.434 . . . . 0.0 110.377 179.218 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -95.03 169.86 9.82 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.418 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -96.69 114.58 26.23 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.404 -179.753 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 23.4 mt -90.6 132.09 36.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.542 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.9 m -100.95 112.86 25.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.753 179.482 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -94.09 151.94 19.13 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.726 179.829 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -124.0 -29.3 3.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.251 -178.783 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.45 ' O ' ' C ' ' A' ' 53' ' ' GLU . 35.1 m -93.39 -103.39 0.13 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.766 0.317 . . . . 0.0 111.143 -179.588 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.45 ' C ' ' O ' ' A' ' 52' ' ' CYS . 16.9 tt0 -32.41 112.36 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.207 -179.553 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.012 -179.945 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 120.847 0.356 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.484 ' O ' ' O ' ' A' ' 3' ' ' LYS . 22.8 t0 69.47 -79.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.711 -179.736 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 2' ' ' ASP . 11.0 tptt 33.29 -156.69 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.058 -179.938 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.458 ' H ' ' CG ' ' A' ' 3' ' ' LYS . 93.4 m -149.48 46.18 0.96 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.904 0.383 . . . . 0.0 111.21 -179.503 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' CD ' ' A' ' 5' ' ' LYS . 2.5 tmtt? -145.94 131.46 18.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.13 114.26 5.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.07 -179.949 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -64.67 130.95 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.304 179.956 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.531 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -71.59 64.26 0.44 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.03 0.443 . . . . 0.0 110.344 179.781 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.531 ' O ' ' O ' ' A' ' 8' ' ' TYR . 3.4 mt-10 29.26 -156.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.147 179.366 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.44 47.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.386 -179.315 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.605 ' O ' ' O ' ' A' ' 12' ' ' PRO . 58.2 t80 -52.25 145.3 19.45 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.183 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.605 ' O ' ' O ' ' A' ' 11' ' ' TYR . 73.8 Cg_exo -49.58 -139.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.895 1.73 . . . . 0.0 112.597 179.863 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.621 ' C ' ' H ' ' A' ' 15' ' ' LYS . 0.5 OUTLIER -179.26 -19.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.743 179.852 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.3 p -64.24 19.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -179.906 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.621 ' H ' ' C ' ' A' ' 13' ' ' VAL . 1.7 tttm -173.89 104.76 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.925 0.393 . . . . 0.0 111.502 -179.909 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.84 110.89 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.072 179.424 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -127.46 -54.02 1.35 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.822 -179.649 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.567 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 0.4 OUTLIER -179.31 89.44 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.794 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.567 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 96.71 174.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.491 0.662 . . . . 0.0 112.62 178.219 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.89 -78.31 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.819 179.265 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -39.04 -85.03 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.581 -179.051 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.8 m -58.15 -40.39 81.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.701 -179.346 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -52.98 -70.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.529 -179.506 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.572 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.55 -54.61 25.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.705 0.288 . . . . 0.0 111.114 -179.551 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 29' ' ' ASP . 29.9 m-20 -49.57 -60.69 2.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.926 -179.514 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 37.9 m -54.98 -32.7 61.83 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.97 179.65 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.24 0.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.318 179.512 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.05 -37.12 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 -179.204 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -65.84 -16.87 64.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.767 0.318 . . . . 0.0 111.101 -179.314 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mmtt -142.6 5.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.967 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.8 36.9 19.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.767 179.897 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.38 -169.76 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.387 -179.744 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -97.85 -20.9 17.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.655 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p 171.31 -163.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.334 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.65 -175.22 46.28 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.589 179.901 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -175.81 158.48 2.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 0.0 110.407 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 3.8 m -87.52 130.53 34.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.49 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -149.21 165.84 30.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.776 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.611 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.3 m-85 -81.88 166.86 19.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.35 179.705 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -124.38 87.08 2.66 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.162 0.506 . . . . 0.0 111.035 179.956 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' A' ' 40' ' ' ASP . 59.1 mt-10 21.25 41.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.5 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.605 ' N ' ' O ' ' A' ' 40' ' ' ASP . 5.0 ttmm -147.13 -76.47 0.18 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.949 0.404 . . . . 0.0 110.979 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 162.71 58.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.558 -179.959 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.611 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 20.2 m-80 -141.01 -164.05 1.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.337 -179.684 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.3 tp -152.64 82.77 1.23 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.857 -179.656 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -92.33 165.63 12.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.21 -179.73 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.0 110.47 22.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.342 -179.696 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.9 mp -89.22 122.25 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.209 179.541 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -93.57 113.39 25.49 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.902 0.382 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -95.2 139.83 30.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.889 -179.819 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -106.95 -11.95 15.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.167 -179.62 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.555 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 56.5 m -143.09 -108.87 0.13 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.263 -179.448 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.555 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 5.3 tt0 89.97 -76.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 -179.662 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.435 ' C ' ' O ' ' A' ' 53' ' ' GLU . 3.2 m-85 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.055 179.747 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 120.704 0.288 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.485 ' O ' ' O ' ' A' ' 3' ' ' LYS . 3.6 t0 -59.94 -39.65 86.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.27 -179.68 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.57 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 11.8 tppt? 57.57 134.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.72 -179.784 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.57 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.4 m 175.66 -20.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.633 -179.815 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.4 122.56 40.58 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.905 179.12 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.424 ' HZ2' ' HG3' ' A' ' 3' ' ' LYS . 2.5 mttm -148.78 144.49 27.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 111.206 -179.064 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.509 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 21.7 m -62.24 162.25 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 CA-C-O 121.165 0.507 . . . . 0.0 111.068 179.52 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.539 ' C ' ' CD1' ' A' ' 8' ' ' TYR . 3.5 p90 -67.71 -29.56 68.84 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.799 -179.653 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.548 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER 26.81 101.87 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.538 -177.458 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.548 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 49.3 m-20 104.91 79.76 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.832 179.903 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.55 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.7 t80 170.42 96.47 0.04 OUTLIER Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.512 179.125 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.579 ' O ' ' N ' ' A' ' 14' ' ' SER . 96.1 Cg_exo -44.86 112.1 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.208 1.938 . . . . 0.0 112.399 -179.996 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.59 73.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.429 -179.838 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.579 ' N ' ' O ' ' A' ' 12' ' ' PRO . 9.2 p -63.79 -24.4 67.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.634 179.641 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -173.48 165.11 4.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.159 179.645 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -173.42 10.37 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -89.0 -33.44 17.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 0.0 110.719 179.863 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.58 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 3.3 mt -70.89 -58.61 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.547 -179.941 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.58 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 105.35 59.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.884 0.74 . . . . 0.0 110.974 -179.256 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.754 HD21 ' N ' ' A' ' 21' ' ' GLN . 0.5 OUTLIER -155.35 -51.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.702 179.695 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.754 ' N ' HD21 ' A' ' 20' ' ' ASN . 0.9 OUTLIER -47.93 -76.74 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.475 179.926 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.55 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -59.74 -42.38 93.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.734 0.302 . . . . 0.0 110.939 179.789 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.599 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 2.7 t-20 -54.7 -76.97 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.106 179.883 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.95 -37.81 21.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.346 179.832 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.598 ' O ' ' N ' ' A' ' 29' ' ' ASP . 68.0 m-20 -55.5 -69.58 0.13 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.655 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.556 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -51.66 -38.16 53.65 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.904 179.828 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.408 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 3.5 mtpt -57.93 3.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.117 179.368 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.556 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.01 -43.64 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.864 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.598 ' N ' ' O ' ' A' ' 25' ' ' ASP . 84.2 m-20 -68.17 -8.08 35.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.699 0.285 . . . . 0.0 111.301 -179.429 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -140.29 13.32 2.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.779 179.925 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 22.0 m170 59.94 38.17 21.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.977 179.321 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.49 -166.13 1.52 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.649 179.181 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.408 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 46.7 ttt180 -129.54 -48.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.972 0.415 . . . . 0.0 110.448 179.558 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.447 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 1.1 p -158.53 124.39 4.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.268 179.531 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.599 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . -130.18 -176.53 14.46 Favored Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.38 -0.914 . . . . 0.0 113.649 -179.234 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -174.93 158.77 2.59 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.537 0.208 . . . . 0.0 110.776 179.929 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 139.03 30.93 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.606 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -149.29 154.34 38.87 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -163.52 172.58 14.22 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.902 -179.43 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.568 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -139.4 -160.65 1.09 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.818 0.342 . . . . 0.0 111.241 -178.964 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.473 ' O ' ' CG ' ' A' ' 41' ' ' GLU . 38.5 tt0 -60.05 3.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.115 -179.417 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.576 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.3 OUTLIER -94.18 4.65 53.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.233 0.539 . . . . 0.0 109.925 179.48 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 46.33 10.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.015 -179.8 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.576 ' H ' ' C ' ' A' ' 42' ' ' LYS . 10.5 m120 -94.68 97.19 9.91 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.143 0.497 . . . . 0.0 110.274 179.462 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.4 tp -89.47 130.31 35.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.677 -178.942 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -137.28 154.57 50.08 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.152 -179.009 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -92.94 111.78 23.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.33 179.834 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.5 mm -80.46 109.94 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.365 179.059 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 m -96.87 115.35 27.27 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.47 0.481 . . . . 0.0 110.721 -179.444 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' A' ' 34' ' ' SER . 1.0 OUTLIER -95.24 131.83 40.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.176 -179.67 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -101.9 -17.4 16.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.178 -179.42 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.9 m -144.1 -19.16 0.57 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.489 -179.977 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 59.28 71.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.731 0.301 . . . . 0.0 110.906 -179.88 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.146 -0.93 . . . . 0.0 110.767 179.945 . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.508 0 CA-C-O 120.841 0.353 . . . . 0.0 111.357 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.539 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 0.0 OUTLIER 61.39 156.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.366 179.851 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.74 36.2 2.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.278 179.972 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.458 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.5 m 47.21 22.52 0.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.938 179.785 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.7 137.77 32.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.481 -179.606 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -149.22 123.01 9.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.497 179.681 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.15 142.63 16.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -81.26 103.16 10.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.435 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.54 ' O ' ' C ' ' A' ' 10' ' ' ASN . 15.4 mm-40 -59.54 168.28 1.67 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.399 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.54 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 11.42 108.21 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.849 0.718 . . . . 0.0 111.883 -179.567 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -177.97 143.48 0.48 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.698 -179.789 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.414 ' C ' ' O ' ' A' ' 11' ' ' TYR . 33.0 Cg_exo -28.98 83.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.179 2.586 . . . . 0.0 113.316 -179.686 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.571 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -58.26 -39.48 73.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.148 179.468 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.23 -39.25 94.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.208 -179.763 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 91.29 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.914 0.388 . . . . 0.0 110.868 -179.908 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -172.86 111.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.392 -179.689 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -149.13 -22.4 0.3 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.504 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.486 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -166.22 176.73 7.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.212 0.529 . . . . 0.0 111.518 -179.27 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.475 ' C ' ' OD1' ' A' ' 20' ' ' ASN . . . -58.71 103.45 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.85 -179.999 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.547 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.6 p-10 176.24 -88.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.973 178.982 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.761 ' N ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -27.57 -85.63 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.418 -0.113 . . . . 0.0 111.231 -179.84 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.601 ' H ' ' NE2' ' A' ' 21' ' ' GLN . 0.8 OUTLIER -52.33 -56.58 13.9 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.6 0.238 . . . . 0.0 111.269 -179.77 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.498 HD21 ' N ' ' A' ' 35' ' ' GLY . 3.9 t-20 -49.05 -74.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.102 0.477 . . . . 0.0 110.49 179.968 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.547 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -49.84 -42.49 47.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.399 179.685 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 29' ' ' ASP . 69.1 m-20 -55.19 -66.47 0.4 Allowed 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.649 -179.688 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 1.8 m -52.69 -39.68 62.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.26 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tptm -57.16 2.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.151 179.849 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.539 ' H ' ' C ' ' A' ' 26' ' ' CYS . 64.0 tp -163.78 -37.56 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -66.81 -51.62 53.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.891 0.377 . . . . 0.0 110.505 179.926 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.519 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -106.12 6.48 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.306 179.8 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.519 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 47.12 49.28 15.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.703 -179.859 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.55 -127.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.444 179.37 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.25 -42.89 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.993 0.425 . . . . 0.0 110.623 179.924 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -158.43 -163.51 1.29 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.32 179.964 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.498 ' N ' HD21 ' A' ' 23' ' ' ASN . . . 167.14 174.69 36.53 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.525 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -175.57 168.73 3.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.778 0.323 . . . . 0.0 110.561 -179.951 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.5 m -88.06 147.49 24.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.277 -179.469 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -146.93 131.41 17.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.606 179.812 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.617 ' CD1' ' O ' ' A' ' 44' ' ' ASN . 21.1 m-85 -74.14 -172.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.399 -179.444 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.502 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 0.8 OUTLIER -163.47 -171.48 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.882 -179.932 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.13 -20.0 63.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.261 -179.638 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 43' ' ' ARG . 19.7 mmtt -99.43 29.11 4.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.046 179.871 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LYS . 11.9 ttt180 35.76 34.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.83 -179.957 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.617 ' O ' ' CD1' ' A' ' 39' ' ' TYR . 2.5 m-20 -94.6 -162.84 0.98 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 -179.949 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.0 mt -146.22 100.06 3.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 110.991 -179.58 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -92.96 149.69 21.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 179.842 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.51 110.31 22.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.116 -179.552 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.407 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 9.6 mm -87.95 128.26 40.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 179.984 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 61.1 m -108.39 116.65 32.36 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 179.513 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.82 133.39 38.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.915 0.388 . . . . 0.0 110.116 179.324 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -100.66 -33.8 10.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.2 -178.751 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.458 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -148.62 -93.26 0.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.654 -179.8 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 179.28 -34.26 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.909 0.385 . . . . 0.0 110.165 179.819 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.295 -0.86 . . . . 0.0 110.615 -179.85 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.622 0 CA-C-O 120.756 0.312 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.81 -103.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.86 -179.939 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.599 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -144.51 131.62 20.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.085 -179.807 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.3 m 159.53 45.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.981 -179.99 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.483 ' NZ ' ' OD2' ' A' ' 50' ' ' ASP . 10.7 mmmt -143.97 92.96 2.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.71 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -96.3 127.46 42.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.691 0.281 . . . . 0.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.2 m -66.03 133.65 30.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 112.091 -179.787 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.483 ' O ' ' O ' ' A' ' 9' ' ' GLU . 13.5 t80 -77.09 93.84 3.94 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.688 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' O ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -47.96 -179.21 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.303 -177.922 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.579 ' O ' ' O ' ' A' ' 9' ' ' GLU . 43.5 m-20 16.34 109.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.675 0.609 . . . . 0.0 111.987 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.674 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 12.8 t80 -173.07 144.52 1.18 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.144 -179.071 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.62 ' O ' ' O ' ' A' ' 11' ' ' TYR . 81.2 Cg_exo -43.56 -134.86 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 123.108 2.539 . . . . 0.0 113.831 -179.378 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.564 ' O ' ' N ' ' A' ' 15' ' ' LYS . 2.2 t -177.46 -56.52 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.879 -179.031 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.8 p -60.08 66.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.865 -178.729 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.697 ' O ' ' N ' ' A' ' 17' ' ' GLN . 4.5 mttm -174.47 -68.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.29 179.201 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.7 ' O ' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER 13.04 -66.5 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 178.94 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.697 ' N ' ' O ' ' A' ' 15' ' ' LYS . 23.4 mt-30 -54.65 51.52 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.638 0.586 . . . . 0.0 111.842 -178.744 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.7 ' N ' ' O ' ' A' ' 16' ' ' CYS . 11.7 mt -165.45 98.79 0.7 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.606 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.51 86.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.849 -179.424 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.617 ' C ' ' H ' ' A' ' 22' ' ' CYS . 3.7 t-20 -173.51 -78.12 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.816 -179.757 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.607 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER -60.46 41.4 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.521 -179.921 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 15.6 m -170.23 -59.01 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.147 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 27' ' ' LYS . 1.0 OUTLIER -56.69 -54.54 45.03 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.576 178.112 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.544 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.92 -47.91 76.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.028 178.957 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.631 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.0 m-20 -58.09 -68.75 0.22 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.409 -179.983 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.537 ' C ' ' H ' ' A' ' 28' ' ' LEU . 56.2 m -51.87 -41.46 61.89 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.023 -179.94 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.455 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 17.0 tttp -59.83 6.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.08 179.776 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.2 tp -164.68 -41.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.532 -0.467 . . . . 0.0 112.121 -179.396 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.631 ' N ' ' O ' ' A' ' 25' ' ' ASP . 55.4 m-20 -69.27 -12.98 62.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.29 -179.746 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.548 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 1.1 mptm? -138.19 6.05 2.56 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.831 0.348 . . . . 0.0 110.639 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.548 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 52.38 35.52 17.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.231 0.539 . . . . 0.0 110.447 -179.818 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.53 -167.22 1.76 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.649 179.702 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.01 -31.04 13.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.11 0.481 . . . . 0.0 109.856 179.63 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -171.93 -175.16 1.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.836 179.719 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.409 ' N ' ' HA ' ' A' ' 23' ' ' ASN . . . -152.11 95.23 0.15 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 119.965 -1.112 . . . . 0.0 113.519 -179.733 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.629 ' CG ' ' H ' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -74.76 -159.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.369 0.604 . . . . 0.0 111.894 179.775 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -153.25 137.69 16.73 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.305 179.559 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -150.71 158.91 44.71 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -178.538 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.764 ' CG ' ' N ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -169.75 -153.71 0.11 Allowed 'General case' 0 C--N 1.343 0.318 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.228 179.548 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.764 ' N ' ' CG ' ' A' ' 39' ' ' TYR . 0.2 OUTLIER 175.12 95.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.63 0.252 . . . . 0.0 111.131 179.333 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.411 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 8.5 mt-10 87.11 -70.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.704 179.565 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.677 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -150.38 29.23 0.71 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -179.665 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.664 ' C ' ' H ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -65.11 16.19 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.954 -179.328 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.677 ' H ' ' C ' ' A' ' 42' ' ' LYS . 30.4 m120 63.15 -15.82 0.06 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.261 -179.919 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.664 ' H ' ' C ' ' A' ' 43' ' ' ARG . 4.3 tp 59.5 133.43 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.904 177.873 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.428 ' OE1' ' C ' ' A' ' 45' ' ' LEU . 1.8 mp0 -141.34 165.05 28.59 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.555 0.693 . . . . 0.0 112.571 -178.514 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.674 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 63.0 m -80.65 110.15 15.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.037 -179.965 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.423 ' O ' ' N ' ' A' ' 36' ' ' GLU . 1.4 mp -93.6 126.23 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.888 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 98.5 m -88.98 117.23 27.84 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.439 179.688 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.573 ' OD1' ' N ' ' A' ' 53' ' ' GLU . 6.8 t70 -93.48 121.13 34.57 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.386 179.481 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -100.38 -17.36 17.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.931 -179.121 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.475 ' O ' ' C ' ' A' ' 53' ' ' GLU . 5.7 m -141.83 56.08 1.49 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.142 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.573 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 1.9 tm-20 28.85 -92.75 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.422 179.332 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.458 ' N ' ' O ' ' A' ' 52' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.77 -179.9 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.59 0 CA-C-O 120.752 0.31 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.559 ' CG ' ' H ' ' A' ' 3' ' ' LYS . 15.4 p30 -147.79 -82.86 0.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.742 179.7 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.569 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -86.09 111.29 20.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.072 0.463 . . . . 0.0 110.877 179.984 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -45.88 -31.52 2.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.481 179.942 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -90.86 133.63 35.08 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.196 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.569 ' NZ ' ' O ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -146.79 122.56 10.57 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.087 178.786 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.0 m -60.87 145.33 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 0.0 111.561 -179.695 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.523 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -87.64 60.35 5.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.001 179.418 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.577 ' C ' ' H ' ' A' ' 11' ' ' TYR . 35.5 mt-10 30.57 -158.61 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.021 179.707 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.422 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 14.7 p30 -58.48 34.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.649 -179.149 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.677 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 5.5 t80 -50.92 135.16 28.22 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.486 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.447 ' C ' ' O ' ' A' ' 11' ' ' TYR . 39.9 Cg_exo -30.95 84.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.329 2.02 . . . . 0.0 112.318 179.512 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.605 ' N ' ' O ' ' A' ' 11' ' ' TYR . 42.9 t -55.77 -15.64 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.956 -179.536 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.4 p -62.16 -93.71 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.8 -179.196 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.405 ' HZ1' ' HB3' ' A' ' 15' ' ' LYS . 2.3 mtpm? -67.82 153.25 44.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.331 0.586 . . . . 0.0 112.35 -178.793 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -174.52 -67.99 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.471 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.413 ' O ' ' C ' ' A' ' 18' ' ' LEU . 6.0 mm100 56.37 28.17 13.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.016 0.436 . . . . 0.0 111.065 179.59 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.413 ' C ' ' O ' ' A' ' 17' ' ' GLN . 40.4 mt 35.59 75.9 0.05 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.22 179.542 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -178.56 -147.94 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.343 179.719 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.548 ' O ' ' C ' ' A' ' 21' ' ' GLN . 3.0 t-20 -21.14 -107.96 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.453 -179.377 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.548 ' C ' ' O ' ' A' ' 20' ' ' ASN . 4.6 mm100 -5.81 -73.88 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.245 -179.575 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.6 t -57.5 -68.61 0.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.478 179.923 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -48.38 -59.5 3.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 -179.69 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.422 179.583 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.636 ' O ' ' N ' ' A' ' 29' ' ' ASP . 22.4 m-20 -50.93 -60.53 2.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.29 179.751 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.531 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.2 m -53.1 -53.98 42.3 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.714 179.278 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 14.27 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.672 -179.832 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.531 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.8 tm? -165.02 -52.19 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 119.876 -0.729 . . . . 0.0 112.613 -179.483 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.636 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -66.05 -15.72 63.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.574 0.226 . . . . 0.0 111.094 -179.06 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -134.31 13.16 3.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.733 0.301 . . . . 0.0 110.834 -179.973 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.4 m80 46.29 36.46 3.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.947 -179.955 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.4 -172.93 4.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.76 179.892 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -95.96 -45.31 6.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.889 179.959 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.411 ' OG ' ' OD1' ' A' ' 50' ' ' ASP . 38.3 p -177.55 154.74 1.01 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.534 179.833 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.63 -164.87 16.34 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.125 -1.036 . . . . 0.0 113.254 -179.684 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -177.19 175.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.699 0.285 . . . . 0.0 110.448 -179.864 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.412 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 0.0 OUTLIER -88.19 149.49 23.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.135 0.493 . . . . 0.0 111.918 -179.834 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' A' ' 37' ' ' CYS . 26.5 m-85 -148.91 145.68 27.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.168 179.388 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.501 ' O ' ' O ' ' A' ' 44' ' ' ASN . 17.0 m-85 -73.79 -102.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -179.522 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.463 ' CG ' ' O ' ' A' ' 39' ' ' TYR . 0.6 OUTLIER 48.97 -167.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.264 0.554 . . . . 0.0 111.086 -179.788 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER 27.64 63.17 0.1 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.307 -178.85 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.513 ' O ' ' N ' ' A' ' 44' ' ' ASN . 5.5 ttpt 69.68 65.95 0.25 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 178.655 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.45 ' C ' ' O ' ' A' ' 42' ' ' LYS . 8.7 mmt85 32.76 33.51 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.558 178.986 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.513 ' N ' ' O ' ' A' ' 42' ' ' LYS . 10.5 m-20 -95.64 129.93 42.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 178.891 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.08 86.38 7.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.13 0.49 . . . . 0.0 110.988 -179.574 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -89.64 158.46 17.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.658 179.832 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.677 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -99.67 108.94 21.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.641 -179.506 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.2 mt -85.83 110.22 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.076 179.498 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.2 m -97.34 121.96 39.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.538 179.438 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.477 ' OD2' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -98.91 134.86 41.17 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.516 0.674 . . . . 0.0 110.859 179.791 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -121.0 66.41 0.86 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.28 -178.917 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.477 ' SG ' ' OD2' ' A' ' 50' ' ' ASP . 77.8 m -99.64 27.47 5.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.777 0.322 . . . . 0.0 111.457 -179.709 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.49 ' CG ' ' O ' ' A' ' 53' ' ' GLU . 5.4 pt-20 -80.98 112.65 18.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.356 179.306 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.533 ' C ' ' CD1' ' A' ' 54' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.863 -179.876 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.457 ' O ' ' O ' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.637 0 CA-C-O 120.814 0.34 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 1' ' ' PCA . 16.2 t0 -56.11 -151.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.195 -179.78 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -65.18 146.3 55.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.0 -179.923 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -124.15 -52.56 1.75 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.283 179.326 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.592 ' H ' ' CD ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -97.87 145.37 26.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.069 0.462 . . . . 0.0 111.039 179.904 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -153.95 110.3 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.763 179.864 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -61.31 137.06 24.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.9 0.381 . . . . 0.0 111.656 -179.869 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.514 ' O ' ' C ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -64.51 66.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.598 179.056 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 7' ' ' VAL . 12.6 mp0 17.21 -115.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.415 178.99 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.667 HD21 ' N ' ' A' ' 10' ' ' ASN . 1.3 m120 -50.34 -72.22 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.784 -179.816 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.663 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 2.4 t80 10.89 79.24 0.06 OUTLIER Pre-proline 0 N--CA 1.466 0.365 0 O-C-N 123.791 0.682 . . . . 0.0 112.147 -178.836 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -46.54 -53.35 6.16 Favored 'Trans proline' 0 CA--C 1.518 -0.304 0 C-N-CA 122.877 2.385 . . . . 0.0 112.524 -179.675 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.49 ' O ' ' C ' ' A' ' 14' ' ' SER . 1.2 t 173.58 -50.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.52 179.615 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.551 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 5.5 p 23.05 55.23 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.875 -179.812 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.551 ' CB ' ' O ' ' A' ' 14' ' ' SER . 28.1 tptt 92.86 141.0 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.489 179.559 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.1 m -174.35 21.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.959 179.795 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.473 ' C ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER -101.03 44.65 1.0 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.342 0.592 . . . . 0.0 110.702 -179.783 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.9 mt -158.84 -129.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.449 179.744 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.43 46.66 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.531 -179.653 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.659 ' ND2' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -141.33 -47.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.611 179.795 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.659 ' N ' ' ND2' ' A' ' 20' ' ' ASN . 5.7 tp60 -47.96 -80.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.835 179.904 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.663 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 22.5 m -62.48 -33.67 75.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.385 -179.902 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -53.46 -65.79 0.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.014 0.435 . . . . 0.0 109.87 179.29 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.569 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.05 -38.58 68.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.071 178.968 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 29' ' ' ASP . 25.2 m-20 -52.45 -63.45 1.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.397 179.622 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.471 ' C ' ' H ' ' A' ' 28' ' ' LEU . 36.8 m -55.27 -39.31 69.68 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.08 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -59.37 3.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.586 -179.6 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.471 ' H ' ' C ' ' A' ' 26' ' ' CYS . 36.1 tp -165.93 -33.2 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.582 ' N ' ' O ' ' A' ' 25' ' ' ASP . 4.7 m-20 -65.83 -16.7 64.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.893 0.378 . . . . 0.0 110.487 -179.656 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.1 mtpm? -144.57 0.29 0.99 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.032 179.801 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m80 62.39 39.08 12.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.455 179.719 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.493 ' CB ' ' CE2' ' A' ' 51' ' ' TYR . . . -86.81 -171.02 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.676 179.538 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.536 ' NE ' ' H ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -89.28 -39.0 13.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.768 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.479 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.3 p -175.85 -147.33 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.294 179.666 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.479 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 149.24 173.48 19.9 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.555 -0.831 . . . . 0.0 113.36 179.952 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.45 ' CD ' ' O ' ' A' ' 35' ' ' GLY . 1.3 pm0 -175.11 172.41 2.81 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.683 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 145.64 25.61 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.663 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -145.15 149.34 34.82 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.35 179.551 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -80.54 150.44 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 111.355 -179.637 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 43' ' ' ARG . 24.8 p30 -99.12 -178.17 3.85 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.144 -179.863 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -63.01 -12.15 24.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.509 -179.477 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -94.92 -77.28 0.47 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.233 179.526 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.402 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 3.1 ptp180 175.45 1.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.329 -0.851 . . . . 0.0 112.161 179.482 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.502 ' N ' HD21 ' A' ' 44' ' ' ASN . 1.4 m-80 -93.97 151.64 19.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 111.316 -179.366 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.471 ' N ' ' CD1' ' A' ' 45' ' ' LEU . 2.9 mp -91.02 153.9 19.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.201 -179.707 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -144.52 132.7 21.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.278 179.689 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 83.8 m -81.35 105.58 12.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 112.073 -179.005 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.1 mt -88.47 120.73 37.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.188 179.43 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.2 m -92.67 119.38 32.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.402 178.889 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -86.63 144.93 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.514 -179.303 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.563 ' N ' ' O ' ' A' ' 4' ' ' CYS . 83.6 m-85 -138.84 42.15 2.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.36 -178.793 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.611 ' O ' ' N ' ' A' ' 54' ' ' TYR . 71.0 m -91.38 -84.65 0.25 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.666 -178.869 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.536 ' H ' ' NE ' ' A' ' 33' ' ' ARG . 8.3 tt0 14.27 -77.46 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.798 0.686 . . . . 0.0 111.881 179.961 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.611 ' N ' ' O ' ' A' ' 52' ' ' CYS . 9.3 m-85 . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.705 179.69 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.428 ' C ' ' OD1' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.447 -0.579 0 CA-C-O 120.799 0.333 . . . . 0.0 111.336 . . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.428 ' OD1' ' C ' ' A' ' 1' ' ' PCA . 0.5 OUTLIER 37.88 -103.25 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.087 179.982 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.632 ' C ' ' H ' ' A' ' 5' ' ' LYS . 22.3 mmtm 59.73 172.32 0.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.97 0.414 . . . . 0.0 111.441 179.923 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 27.7 m 62.93 -24.87 0.06 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.966 179.948 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.632 ' H ' ' C ' ' A' ' 3' ' ' LYS . 10.2 mtpp -142.58 103.61 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.65 0.262 . . . . 0.0 110.465 179.859 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -142.05 131.67 24.01 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.219 0.533 . . . . 0.0 111.635 -179.502 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.452 ' C ' ' H ' ' A' ' 9' ' ' GLU . 2.4 m -66.57 153.19 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.107 178.745 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.585 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.4 OUTLIER -81.81 36.3 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.086 0.47 . . . . 0.0 110.154 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.503 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.3 pt-20 10.86 -100.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.946 179.066 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 11' ' ' TYR . 2.7 m120 -43.22 -72.45 0.06 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.501 -178.767 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.529 ' C ' ' O ' ' A' ' 10' ' ' ASN . 33.5 t80 16.57 102.12 0.02 OUTLIER Pre-proline 0 N--CA 1.469 0.508 0 O-C-N 123.471 0.482 . . . . 0.0 111.819 -178.93 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -42.6 93.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.319 2.012 . . . . 0.0 112.936 -179.568 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.9 t -56.2 96.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.9 p -178.57 23.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.119 179.633 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -174.45 107.71 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.378 -179.987 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -170.25 -10.58 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.156 -179.373 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -62.57 19.69 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.757 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.645 ' H ' ' C ' ' A' ' 16' ' ' CYS . 14.0 mt -164.73 134.32 3.73 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.741 0.305 . . . . 0.0 110.324 179.954 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.428 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.16 -176.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 0.0 111.265 179.652 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.4 OUTLIER 81.9 -78.34 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.753 -179.828 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.49 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -29.15 -83.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.079 179.982 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.39 -46.07 91.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.061 0.458 . . . . 0.0 110.926 179.548 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.82 -75.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.22 -179.634 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.516 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -47.43 -47.19 26.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.869 -179.947 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.583 ' O ' ' N ' ' A' ' 29' ' ' ASP . 88.7 m-20 -52.12 -73.64 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.575 -179.248 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -51.59 -38.29 53.82 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.913 -179.833 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.405 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 64.9 tttt -63.15 7.18 0.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.964 179.392 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.51 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.8 tt -161.96 -22.29 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.859 -179.529 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -69.32 -55.59 10.01 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.025 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -101.17 3.44 41.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.134 179.312 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.9 m80 70.66 45.29 0.59 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.665 -179.547 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.49 -143.95 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.32 -179.717 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 50' ' ' ASP . 0.6 OUTLIER -142.54 -31.68 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.136 179.977 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 p -157.52 117.69 3.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.819 0.343 . . . . 0.0 111.876 -179.635 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -104.6 71.86 0.25 Allowed Glycine 0 C--N 1.337 0.584 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.596 179.731 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -73.25 179.5 3.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.116 0.484 . . . . 0.0 111.816 -179.998 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -148.17 142.51 26.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.941 179.587 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -148.7 143.41 26.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -178.769 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.479 ' C ' ' CD1' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -169.71 159.01 7.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.195 -1.366 . . . . 0.0 109.841 179.034 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -96.62 -82.51 0.4 Allowed 'General case' 0 CA--C 1.502 -0.87 0 CA-C-O 121.214 0.53 . . . . 0.0 111.91 -178.966 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.487 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -165.48 8.26 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.515 -179.657 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.414 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -98.12 2.93 49.1 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.768 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.414 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER 80.69 21.13 0.45 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.201 179.917 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -94.14 74.46 4.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-O 121.604 0.716 . . . . 0.0 109.845 179.001 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.2 tp -97.81 139.1 34.18 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.517 -1.22 . . . . 0.0 112.6 -178.09 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -141.85 144.89 34.1 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.022 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -97.38 110.1 22.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.808 -179.835 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -87.71 112.21 23.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 179.774 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.2 m -105.85 104.37 14.07 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.291 179.929 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 33' ' ' ARG . 4.3 t70 -96.16 136.18 36.97 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.008 179.275 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -101.84 -24.45 14.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.7 -178.548 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.603 ' O ' ' CG ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -137.81 -82.99 0.33 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.136 179.803 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.603 ' CG ' ' O ' ' A' ' 52' ' ' CYS . 0.3 OUTLIER 119.63 27.2 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.717 0 O-C-N 124.534 1.147 . . . . 0.0 110.292 179.854 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 53' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.498 179.783 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.593 0 CA-C-O 120.785 0.326 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -100.73 169.97 8.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 -179.983 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.13 -168.8 2.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.579 179.91 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m -116.03 -45.73 2.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.362 -179.633 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -97.07 146.16 25.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.487 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 mtpm? -150.33 121.34 7.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.994 0.426 . . . . 0.0 111.376 -179.942 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -66.04 151.3 10.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.902 179.407 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.555 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.6 OUTLIER -83.88 81.88 8.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.687 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 17.0 pt-20 -61.61 72.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.616 -179.495 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.579 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 31.4 t30 127.04 101.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.511 1.132 . . . . 0.0 110.527 -179.871 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -179.3 134.15 0.28 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.55 ' C ' ' H ' ' A' ' 14' ' ' SER . 89.0 Cg_endo -79.58 122.54 5.05 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.171 1.914 . . . . 0.0 112.553 -179.972 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.6 t -61.16 43.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.243 179.606 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.598 ' C ' ' H ' ' A' ' 16' ' ' CYS . 10.1 p -62.6 -110.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.952 0.406 . . . . 0.0 111.434 -179.502 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -67.59 23.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.41 -179.633 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -66.04 -26.06 67.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.751 179.736 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -67.38 12.67 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.973 -179.806 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.579 ' H ' ' C ' ' A' ' 16' ' ' CYS . 16.8 mt -162.89 124.34 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.426 -179.862 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.04 107.37 0.35 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.481 ' C ' HD21 ' A' ' 20' ' ' ASN . 0.4 OUTLIER -174.56 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.267 179.998 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -46.13 -64.66 0.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.355 -179.652 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 t -56.11 -53.52 56.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.274 -179.545 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -51.68 -72.59 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.931 -179.845 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.81 -44.57 28.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.437 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 7.2 m-20 -55.51 -74.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.498 -179.542 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.514 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -52.17 -34.09 43.49 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.164 -179.658 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.21 1.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.263 179.34 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.514 ' H ' ' C ' ' A' ' 26' ' ' CYS . 57.9 tp -162.92 -29.82 0.04 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.991 -179.728 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.06 -48.58 57.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.765 0.317 . . . . 0.0 110.692 179.846 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -100.2 18.03 19.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.938 -179.918 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.1 m170 55.43 44.74 26.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 -179.727 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.4 -160.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.493 -179.732 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.507 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 40.4 ttm-85 -139.01 -27.3 0.82 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 -179.856 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 1.5 p -178.64 120.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.126 179.712 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -118.91 179.37 16.79 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.363 -179.271 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -178.71 145.71 0.31 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.65 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.93 131.37 34.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.833 0.349 . . . . 0.0 111.181 -179.675 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -146.7 171.35 15.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.303 -179.653 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -86.13 134.53 33.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.225 179.318 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 42' ' ' LYS . 2.4 p-10 -142.07 -83.23 0.19 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.19 0.519 . . . . 0.0 112.165 -179.101 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.576 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.1 OUTLIER -59.72 70.47 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.221 -178.095 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.4 mptt 53.81 85.07 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.536 179.252 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.609 ' HE ' ' N ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER 57.92 18.49 5.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.756 179.109 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.576 ' ND2' ' O ' ' A' ' 41' ' ' GLU . 1.9 m-80 -93.8 115.75 28.18 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 179.327 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.75 93.07 7.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.407 -179.026 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -100.94 -178.92 3.9 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.39 179.87 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -104.79 104.07 13.79 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.491 -179.568 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.615 ' N ' ' CD1' ' A' ' 48' ' ' ILE . 1.0 OUTLIER -88.65 109.53 20.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.511 179.305 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.0 m -96.95 119.18 34.94 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.774 0.321 . . . . 0.0 111.267 -179.709 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.503 ' CB ' ' O ' ' A' ' 34' ' ' SER . 2.2 t0 -94.48 137.08 34.05 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.185 0.517 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.507 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 5.6 m-85 -103.61 -17.89 14.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.46 179.996 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.0 m -113.49 -116.42 0.32 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.972 -179.59 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 169.26 -58.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.775 -179.99 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.813 -179.882 . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.584 0 CA-C-O 120.801 0.334 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -84.46 -101.89 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.977 -179.95 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 36.9 mttm -48.05 160.65 0.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.144 -179.751 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -8.44 2.3 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.558 179.726 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.41 ' O ' ' CE ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -147.08 145.55 29.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.998 179.972 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.466 ' HZ2' ' CD ' ' A' ' 9' ' ' GLU . 8.3 tttp -146.73 116.86 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.128 0.49 . . . . 0.0 110.861 -179.777 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -63.25 142.75 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.456 -179.573 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.602 ' C ' ' H ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -62.78 110.95 1.91 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.833 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.466 ' CD ' ' HZ2' ' A' ' 6' ' ' LYS . 26.7 mt-10 -60.65 5.86 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.398 -178.674 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.602 ' H ' ' C ' ' A' ' 8' ' ' TYR . 1.8 p-10 172.2 122.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.8 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.627 ' O ' ' N ' ' A' ' 13' ' ' VAL . 19.8 t80 -179.72 123.54 0.23 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.089 179.955 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.14 76.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.397 2.065 . . . . 0.0 113.138 -179.634 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.627 ' N ' ' O ' ' A' ' 11' ' ' TYR . 1.4 p -58.68 97.15 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.144 0.497 . . . . 0.0 110.981 179.849 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.562 ' C ' ' H ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -178.0 -57.78 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.778 -179.867 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.571 ' C ' ' H ' ' A' ' 17' ' ' GLN . 13.7 tttp -67.21 10.25 0.17 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.666 179.987 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.562 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -67.61 19.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.233 -179.921 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.571 ' H ' ' C ' ' A' ' 15' ' ' LYS . 0.4 OUTLIER -88.33 56.32 3.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 110.875 -179.682 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.5 mp -161.92 -122.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.671 179.737 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 174.01 28.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 -179.688 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 21' ' ' GLN . 29.1 t-20 -131.19 -52.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.486 179.961 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.446 ' HB3' ' HH ' ' A' ' 11' ' ' TYR . 8.2 mm-40 -37.19 -86.87 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.916 -179.764 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.8 m -59.87 -37.33 79.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.536 0.208 . . . . 0.0 111.326 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.485 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 13.5 t-20 -56.28 -75.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.68 0.276 . . . . 0.0 110.954 179.788 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.512 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -48.86 -43.57 38.93 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.906 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.598 ' O ' ' N ' ' A' ' 29' ' ' ASP . 10.7 m-20 -51.89 -57.36 9.61 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.684 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.424 ' C ' ' H ' ' A' ' 28' ' ' LEU . 96.3 m -53.62 -44.55 69.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.406 0.622 . . . . 0.0 109.464 178.801 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -62.51 7.51 0.07 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 113.165 -178.78 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.424 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -167.87 -37.65 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.933 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.598 ' N ' ' O ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -66.79 -12.55 59.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.769 0.319 . . . . 0.0 111.081 -179.259 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -144.63 10.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.082 179.768 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.7 m80 54.9 46.8 23.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.555 -179.883 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.6 -174.19 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.382 -179.664 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.401 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 0.9 OUTLIER -96.66 -59.63 1.77 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.229 179.586 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.449 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 3.9 p -158.05 114.05 2.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.694 179.991 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.485 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -105.62 164.26 13.99 Favored Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.142 -179.618 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -176.43 167.66 2.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.982 0.42 . . . . 0.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.4 m -89.29 130.01 35.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.278 -179.716 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -148.22 161.98 40.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.955 179.898 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.58 ' O ' ' N ' ' A' ' 41' ' ' GLU . 75.4 m-85 -91.2 115.28 27.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.816 179.799 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 6.8 p-10 -57.11 77.12 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.51 0.671 . . . . 0.0 110.492 179.854 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 39' ' ' TYR . 34.4 mt-10 27.87 40.57 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.688 -1.142 . . . . 0.0 112.177 -179.724 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -142.23 -81.83 0.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.099 178.807 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 10.1 mtp180 160.74 23.73 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.97 179.789 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.474 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 98.9 m-20 -97.65 -13.61 21.42 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.591 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.447 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 5.9 tp 57.68 122.19 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.644 0.259 . . . . 0.0 111.15 -179.665 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.474 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -149.54 -179.14 6.86 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.423 179.107 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.524 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 36.3 m -102.07 139.14 38.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 14.5 mt -139.4 121.21 16.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 0.0 112.052 -178.884 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 m -92.63 124.11 36.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.018 178.468 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' A' ' 34' ' ' SER . 9.0 t70 -88.49 124.38 33.93 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.126 0.489 . . . . 0.0 111.192 -179.319 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -115.18 50.2 1.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.311 -179.383 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 69.4 m -87.75 28.24 1.04 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.542 179.916 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' A' ' 54' ' ' TYR . 5.4 tm-20 -49.86 122.01 6.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.607 179.549 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.463 ' O ' ' OE1' ' A' ' 53' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.852 -179.724 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.494 ' C ' ' H ' ' A' ' 3' ' ' LYS . . . . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 120.937 0.399 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.483 ' O ' ' CB ' ' A' ' 3' ' ' LYS . 4.5 t70 73.76 -14.44 0.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.694 -179.683 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.647 ' CB ' ' HZ1' ' A' ' 3' ' ' LYS . 0.0 OUTLIER 84.08 86.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.068 179.844 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 68.6 m 53.22 39.18 29.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.105 179.752 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 135.5 26.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.436 179.924 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -149.79 121.87 8.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.913 0.387 . . . . 0.0 111.285 179.829 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -61.85 161.98 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.179 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.233 179.782 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -113.15 84.49 2.01 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.473 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.598 ' CD ' ' H ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -57.94 -79.62 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.146 -178.174 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.598 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 6.9 t-20 -38.96 -38.88 0.48 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.696 -178.416 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.443 ' HH ' ' HB3' ' A' ' 21' ' ' GLN . 53.0 t80 -52.87 124.84 37.56 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.585 -178.939 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.602 ' C ' ' H ' ' A' ' 14' ' ' SER . 73.0 Cg_exo -46.35 112.32 0.45 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 122.148 1.898 . . . . 0.0 112.579 179.567 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.3 p -60.59 7.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.477 179.598 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.602 ' H ' ' C ' ' A' ' 12' ' ' PRO . 5.1 p -60.66 -108.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.558 -179.252 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 ttpm? -63.44 149.74 45.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 -179.527 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -171.94 3.92 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.608 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.519 ' CA ' HE21 ' A' ' 17' ' ' GLN . 0.1 OUTLIER -86.62 -32.24 20.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.978 -179.892 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.602 ' C ' ' H ' ' A' ' 20' ' ' ASN . 1.3 mm? -68.86 116.26 9.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.726 -179.415 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.19 39.06 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.076 179.161 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.602 ' H ' ' C ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -136.71 -108.04 0.2 Allowed 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.941 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.555 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER 0.9 -80.59 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.069 0.547 . . . . 0.0 112.439 179.182 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.0 t -58.01 -58.07 10.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.889 179.848 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -52.83 -56.96 11.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.459 179.957 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -53.14 -52.52 58.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.352 179.46 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.8 m-20 -50.99 -50.16 58.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.29 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.534 ' C ' ' H ' ' A' ' 28' ' ' LEU . 1.2 m -51.83 -54.26 30.96 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.447 0.641 . . . . 0.0 109.331 178.696 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -61.25 14.75 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.683 -179.806 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.9 OUTLIER -167.2 -53.63 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.378 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -65.81 -13.26 59.15 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.569 0.223 . . . . 0.0 111.483 -178.884 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 31' ' ' HIS . 3.0 mmmp? -139.79 24.02 2.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.009 0.433 . . . . 0.0 110.776 179.875 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.441 ' C ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 34.0 38.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.089 179.636 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.76 179.99 6.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.909 0.385 . . . . 0.0 110.937 179.923 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 mmm-85 -92.27 -27.19 17.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.266 0.555 . . . . 0.0 109.837 179.724 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.6 p 178.37 -168.09 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.836 179.629 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.41 -177.16 47.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.352 179.975 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.45 -154.42 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -179.836 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.94 142.86 30.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.733 0.301 . . . . 0.0 110.574 179.493 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -146.88 164.41 32.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.124 0.487 . . . . 0.0 111.585 -179.41 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -101.59 119.3 38.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.078 -179.8 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.624 ' C ' ' H ' ' A' ' 42' ' ' LYS . 11.4 p-10 -51.75 168.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.623 179.703 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -64.22 36.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.495 -179.835 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.624 ' H ' ' C ' ' A' ' 40' ' ' ASP . 3.6 mmtp -146.86 -81.25 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.171 179.625 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -176.82 20.7 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.112 179.677 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.78 124.66 46.75 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.65 179.527 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.6 tp -89.51 138.48 31.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.389 179.424 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -147.61 145.8 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 111.63 -179.459 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -82.67 109.02 16.48 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.929 -179.96 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.9 mt -90.3 116.88 32.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.912 0.387 . . . . 0.0 111.86 -179.925 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.47 120.1 36.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.685 179.412 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.28 136.28 34.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.958 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -111.16 -6.34 14.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.598 -179.29 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.7 m -143.48 -113.65 0.11 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.035 0.445 . . . . 0.0 111.822 -179.294 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 67.8 127.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.855 -179.372 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.643 179.868 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.855 0.36 . . . . 0.0 110.692 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.67 122.48 13.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.752 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.93 125.48 45.94 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.436 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.573 ' O ' ' N ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -67.07 127.86 29.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.32 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.535 ' O ' ' C ' ' A' ' 9' ' ' GLU . 2.9 t80 -61.25 73.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 7' ' ' VAL . 15.0 mp0 16.36 -125.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.67 0.606 . . . . 0.0 111.139 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 57.8 t-20 -57.21 -122.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 6.5 t80 97.64 95.67 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.609 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.24 115.47 1.75 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 121.786 1.658 . . . . 0.0 111.486 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 15' ' ' LYS . 68.0 t -50.69 -50.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.884 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 69.6 p 19.12 -79.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.502 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 13' ' ' VAL . 21.3 tptp -65.44 -87.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.155 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.468 ' C ' ' O ' ' A' ' 15' ' ' LYS . 2.2 m 28.1 81.3 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 121.021 0.438 . . . . 0.0 111.625 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -142.26 -23.73 0.67 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.689 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.425 ' O ' ' O ' ' A' ' 19' ' ' ALA . 1.4 mt -165.17 -176.41 4.08 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.366 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -54.73 -157.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.118 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 21' ' ' GLN . 10.7 t-20 76.38 -87.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.104 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.448 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -30.29 -90.37 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.729 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.6 m -55.68 -45.42 77.79 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 1.7 t-20 -51.83 -71.74 0.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.428 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -49.91 -59.52 3.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.359 -179.452 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.9 m-20 -49.17 -54.75 14.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.505 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.0 m -54.74 -41.98 71.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -62.14 10.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.012 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.672 ' O ' HD23 ' A' ' 28' ' ' LEU . 6.0 tt -165.49 -45.52 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.615 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 9.9 m-20 -67.16 -15.26 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.082 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -141.37 30.07 1.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.0 0.428 . . . . 0.0 110.808 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.453 ' C ' ' O ' ' A' ' 30' ' ' LYS . 4.5 m80 32.42 39.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.242 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 30' ' ' LYS . . . -87.69 -176.64 5.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.827 0.346 . . . . 0.0 111.037 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.96 -38.28 11.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.328 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -163.61 -157.08 0.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.401 179.595 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.519 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 163.07 169.21 26.17 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.143 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -178.05 170.2 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 55.4 m -86.7 127.39 34.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.767 0.318 . . . . 0.0 110.484 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.41 ' HB2' HD13 ' A' ' 48' ' ' ILE . 39.2 m-85 -142.12 165.98 25.95 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.373 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.475 ' HB2' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -145.1 -178.1 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.856 179.898 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -121.79 -178.29 3.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.072 -179.906 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.32 42.97 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.399 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.539 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER -138.44 -25.29 0.93 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.932 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.539 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 2.2 tpt180 89.63 61.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.27 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 43' ' ' ARG . 4.9 m-20 -142.87 105.73 4.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.583 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.484 ' O ' HG22 ' A' ' 13' ' ' VAL . 35.8 mt -86.57 136.2 33.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.543 0.687 . . . . 0.0 112.566 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.494 ' O ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -145.67 153.87 41.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.22 179.4 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.535 ' SG ' ' CZ ' ' A' ' 11' ' ' TYR . 1.8 m -75.89 101.37 5.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.368 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 46' ' ' GLN . 2.1 mp -89.27 121.7 39.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.796 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.3 m -95.64 117.3 30.21 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.52 133.86 34.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.0 0.429 . . . . 0.0 111.542 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -103.63 -25.71 13.07 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.18 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 120.952 0.406 . . . . 0.0 111.159 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.531 0.234 0 CA-C-O 120.517 0.198 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -95.81 139.46 32.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.998 0.427 . . . . 0.0 111.275 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -140.39 101.83 4.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.818 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.442 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -61.8 130.39 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.814 -178.924 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.477 ' O ' ' C ' ' A' ' 9' ' ' GLU . 1.1 t80 -72.66 67.33 0.77 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.477 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.0 mt-10 32.11 -149.7 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.302 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.587 ' CG ' ' H ' ' A' ' 11' ' ' TYR . 9.3 p30 -50.9 -67.33 0.26 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.401 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.587 ' H ' ' CG ' ' A' ' 10' ' ' ASN . 23.4 t80 99.4 128.72 0.02 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 C-N-CA 123.306 0.643 . . . . 0.0 110.585 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.714 ' O ' HG23 ' A' ' 13' ' ' VAL . 72.6 Cg_exo -44.92 -69.16 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 121.353 1.369 . . . . 0.0 111.759 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.779 ' O ' HG12 ' A' ' 13' ' ' VAL . 66.2 t 110.44 18.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.801 1.313 . . . . 0.0 110.148 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.29 -21.52 65.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.639 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.94 141.04 0.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.923 0.392 . . . . 0.0 111.098 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -176.65 58.67 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.467 0.651 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.496 ' C ' HD12 ' A' ' 18' ' ' LEU . 95.1 mm-40 -106.58 -22.72 12.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.704 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.496 HD12 ' C ' ' A' ' 17' ' ' GLN . 3.6 mp -163.38 170.47 17.46 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.466 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 113.02 1.51 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.668 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 15.9 t30 -178.77 -95.9 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.172 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -46.11 -53.63 9.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.888 0.375 . . . . 0.0 110.319 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.1 t -60.55 -55.91 27.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.741 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -52.95 -65.98 0.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.468 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.531 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.29 -47.28 36.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.616 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.5 m-20 -53.55 -62.21 1.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.76 0.314 . . . . 0.0 110.531 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.48 ' C ' ' H ' ' A' ' 28' ' ' LEU . 99.3 m -54.4 -41.02 68.8 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.135 0.493 . . . . 0.0 109.968 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 5.24 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.917 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.48 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.4 tp -163.22 -47.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.375 -0.53 . . . . 0.0 112.256 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.616 ' N ' ' O ' ' A' ' 25' ' ' ASP . 72.9 m-20 -66.01 -10.95 44.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.241 0.543 . . . . 0.0 109.655 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 31' ' ' HIS . 4.2 tptt -143.33 9.79 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.067 179.234 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.43 ' C ' ' O ' ' A' ' 30' ' ' LYS . 3.3 p80 35.2 43.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.83 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.43 -166.21 1.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.835 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -33.95 11.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.626 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -174.06 -154.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.701 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.46 ' C ' ' OE1' ' A' ' 36' ' ' GLU . . . 152.73 179.65 28.45 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.532 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.46 ' OE1' ' C ' ' A' ' 35' ' ' GLY . 6.7 pm0 -177.53 175.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.671 -0.265 . . . . 0.0 110.307 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.09 148.94 22.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 0.0 111.4 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -146.61 146.02 30.28 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.434 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.483 ' CE1' HD22 ' A' ' 45' ' ' LEU . 11.2 m-85 -76.87 151.44 35.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.103 0.478 . . . . 0.0 111.867 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -101.33 -179.89 4.16 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.759 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -64.7 -7.84 12.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.077 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.32 -80.4 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.08 32.68 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.75 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -128.87 144.53 51.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.82 0.343 . . . . 0.0 111.044 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.483 HD22 ' CE1' ' A' ' 39' ' ' TYR . 0.1 OUTLIER -90.74 148.06 22.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.126 0.489 . . . . 0.0 111.162 -179.802 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -141.78 147.51 37.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.061 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.691 ' C ' HD12 ' A' ' 48' ' ' ILE . 0.8 OUTLIER -70.9 143.21 51.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 112.127 -179.214 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.691 HD12 ' C ' ' A' ' 47' ' ' CYS . 2.0 mp -136.1 115.23 16.12 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.128 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.3 m -91.85 124.71 36.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.493 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -92.98 127.69 38.58 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.878 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -104.52 -3.33 24.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.135 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.466 0.334 0 CA-C-O 120.973 0.416 . . . . 0.0 111.06 179.9 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 111.331 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.416 ' HB3' ' HZ2' ' A' ' 5' ' ' LYS . 0.6 OUTLIER -90.23 136.49 33.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.428 -178.829 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -149.9 123.53 9.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.986 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.64 145.1 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.351 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.562 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.2 t80 -92.29 74.5 5.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.818 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.562 ' O ' ' O ' ' A' ' 8' ' ' TYR . 25.8 mt-10 21.12 110.15 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.789 0.681 . . . . 0.0 112.72 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.503 ' C ' ' O ' ' A' ' 9' ' ' GLU . 3.9 t30 15.67 56.94 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.204 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.646 ' CD2' ' SG ' ' A' ' 47' ' ' CYS . 87.4 t80 -54.13 110.15 1.94 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.023 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.606 ' O ' ' N ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.05 117.2 1.77 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.833 1.689 . . . . 0.0 112.148 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.406 ' H ' HG23 ' A' ' 13' ' ' VAL . 2.4 t -60.2 41.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.065 -179.668 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.606 ' N ' ' O ' ' A' ' 12' ' ' PRO . 25.2 p -63.68 -32.3 73.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.862 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -172.56 141.52 1.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.294 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -173.09 0.07 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -87.49 46.73 1.41 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.532 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 1.8 mt -167.48 -95.85 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.262 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 170.81 -165.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.827 0.346 . . . . 0.0 110.146 -178.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.584 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.7 t30 60.6 -74.55 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.515 ' N ' ' O ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -35.62 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 109.969 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.71 -45.44 92.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.449 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -56.81 -76.2 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.088 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.584 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -42.3 -41.01 2.64 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.634 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.489 ' O ' ' N ' ' A' ' 29' ' ' ASP . 1.2 m-20 -52.88 -61.51 2.25 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.481 ' C ' ' H ' ' A' ' 28' ' ' LEU . 73.4 m -51.79 -47.33 64.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.501 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -61.18 12.22 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.674 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.8 tt -166.6 -37.88 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -66.62 -14.57 62.59 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.692 -179.378 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -143.2 3.55 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.2 m170 63.51 43.35 5.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.723 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.677 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -88.48 -178.55 5.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.011 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.435 ' HE ' ' C ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -92.82 -35.09 13.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.321 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.7 p -172.37 -159.59 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.928 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.17 175.59 23.96 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.83 -1.176 . . . . 0.0 113.524 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG3' ' CE2' ' A' ' 38' ' ' PHE . 3.1 pt-20 -178.59 165.97 1.73 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.502 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.7 OUTLIER -88.16 146.62 25.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.011 0.434 . . . . 0.0 111.514 -179.159 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CE2' ' HG3' ' A' ' 36' ' ' GLU . 33.8 m-85 -144.84 160.03 41.94 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.312 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 40' ' ' ASP . 7.6 m-85 -94.38 86.62 4.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.717 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.581 ' OD2' ' NE2' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -42.34 167.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.776 0.322 . . . . 0.0 110.342 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.01 -0.32 0.68 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.93 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -110.46 17.63 20.6 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? 60.62 61.45 1.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.156 0.503 . . . . 0.0 110.595 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.483 ' O ' ' OD1' ' A' ' 40' ' ' ASP . 87.4 m-20 -147.12 129.74 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.681 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 39' ' ' TYR . 4.7 mt -85.43 100.73 12.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.581 ' NE2' ' OD2' ' A' ' 40' ' ' ASP . 72.1 mt-30 -113.53 145.96 40.39 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.467 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.1 m -82.5 101.49 10.74 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.982 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 mp -88.42 111.77 22.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 82.7 m -93.85 125.3 38.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.266 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.677 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 65.3 t0 -95.19 140.74 29.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.959 0.409 . . . . 0.0 110.91 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.51 ' CE2' ' HB2' ' A' ' 32' ' ' ALA . 55.8 m-85 -128.91 66.8 1.42 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.323 -178.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.435 ' C ' ' HE ' ' A' ' 33' ' ' ARG . 72.7 m . . . . . 0 C--N 1.328 -0.352 0 CA-C-O 121.048 0.451 . . . . 0.0 110.875 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.503 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.7 m . . . . . 0 CA--C 1.533 0.289 0 CA-C-O 120.77 0.319 . . . . 0.0 111.234 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.95 136.48 24.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 111.068 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -151.83 133.19 14.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.142 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.407 HG13 ' H ' ' A' ' 7' ' ' VAL . 1.4 m -65.72 152.56 9.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.367 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.446 ' C ' ' CD1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER -94.47 98.08 10.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.552 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -66.28 116.03 6.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.581 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.409 ' HB2' ' CE1' ' A' ' 8' ' ' TYR . 28.5 t-20 -178.45 -98.58 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.136 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.8 149.79 15.81 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.583 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.495 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 72.3 Cg_endo -75.16 10.91 1.62 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.464 2.109 . . . . 0.0 111.721 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.721 ' O ' HG12 ' A' ' 13' ' ' VAL . 97.8 t 102.06 2.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 124.72 1.262 . . . . 0.0 110.586 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.554 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 24.8 p -60.73 -75.08 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.554 ' N ' ' OG ' ' A' ' 14' ' ' SER . 29.6 mttm -66.96 102.58 1.0 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.225 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -172.37 28.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.416 -179.423 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -115.12 37.8 3.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.255 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 20' ' ' ASN . 0.5 OUTLIER -169.37 119.16 0.67 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.792 0.33 . . . . 0.0 111.159 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.23 52.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.165 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 18' ' ' LEU . 56.8 t-20 -140.87 -82.37 0.23 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.725 0.298 . . . . 0.0 111.24 -179.434 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 38.5 tp60 -38.19 -61.69 0.64 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.911 0.386 . . . . 0.0 110.826 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.81 -54.62 39.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.251 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -54.45 -64.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.792 0.329 . . . . 0.0 110.247 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 0.4 OUTLIER -50.64 -39.76 51.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.89 179.238 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.1 m-20 -55.36 -58.5 7.47 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.464 ' C ' ' H ' ' A' ' 28' ' ' LEU . 61.7 m -52.39 -43.55 64.82 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -59.62 7.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.583 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.7 tp -166.35 -37.02 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.515 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.5 m-20 -66.16 -13.27 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.371 . . . . 0.0 110.739 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -142.34 0.4 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.1 m80 64.33 45.43 3.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.945 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.75 -178.46 5.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.255 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.64 -32.01 12.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.305 0.574 . . . . 0.0 110.065 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.2 p 178.07 146.12 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.536 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.94 -177.16 23.7 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.845 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -178.62 168.63 1.75 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 0.0 110.918 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.8 m -88.8 132.22 34.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.437 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -143.79 164.83 29.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.534 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -91.41 104.52 17.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.996 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.529 ' C ' ' H ' ' A' ' 42' ' ' LYS . 8.9 p-10 -92.34 -177.48 4.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.041 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -63.29 39.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.616 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 21.11 1.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.869 0.366 . . . . 0.0 110.612 179.665 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 40.54 39.83 0.8 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.159 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -144.49 159.8 42.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.569 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.573 ' O ' HG13 ' A' ' 13' ' ' VAL . 9.6 mt -85.4 94.98 9.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.688 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -90.47 139.94 30.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.396 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -83.8 93.77 8.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.9 mt -83.47 118.04 30.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.931 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 8' ' ' TYR . 39.7 m -97.61 112.98 24.63 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.392 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -95.15 132.33 40.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 110.666 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.31 -42.69 7.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.548 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.503 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 23.0 m . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.652 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.173 0 CA-C-O 120.575 0.226 . . . . 0.0 111.11 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.85 135.57 35.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.99 0.424 . . . . 0.0 111.235 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -147.89 130.52 15.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.104 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -64.44 127.68 25.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.502 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.607 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 28.8 t80 -74.56 2.55 9.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.253 0.549 . . . . 0.0 110.527 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.56 ' O ' ' C ' ' A' ' 10' ' ' ASN . 9.9 pt-20 32.54 -154.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.676 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.56 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 11.89 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.457 0.473 . . . . 0.0 111.676 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.438 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 4.6 t80 -176.81 133.23 0.38 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.099 -179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.586 ' O ' ' N ' ' A' ' 14' ' ' SER . 61.0 Cg_endo -71.0 47.28 0.73 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.128 1.885 . . . . 0.0 112.135 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.515 ' C ' ' O ' ' A' ' 12' ' ' PRO . 2.8 t 12.02 54.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.713 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 12' ' ' PRO . 74.8 p -63.58 -125.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.7 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 32.4 mttm -67.45 161.28 25.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.64 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 1.3 m -173.42 93.89 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.386 0.613 . . . . 0.0 111.34 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.475 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 3.1 mm-40 156.46 -48.02 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.782 -1.099 . . . . 0.0 108.888 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.6 mt -75.59 125.47 29.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.732 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.86 92.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.367 . . . . 0.0 110.672 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.551 ' CG ' ' H ' ' A' ' 21' ' ' GLN . 19.4 t-20 -173.43 -121.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.551 ' H ' ' CG ' ' A' ' 20' ' ' ASN . 14.3 mm-40 -5.17 -79.45 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.918 0.761 . . . . 0.0 112.412 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -55.72 31.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.447 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 20' ' ' ASN . 35.0 t30 -53.13 -61.62 2.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.346 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.74 -57.62 8.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -50.1 -53.67 25.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.218 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.653 ' C ' ' H ' ' A' ' 28' ' ' LEU . 84.0 m -57.69 -47.13 83.21 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.457 ' HE3' ' ND2' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -61.24 11.0 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.119 178.454 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.678 ' O ' ' N ' ' A' ' 30' ' ' LYS . 9.1 tp -161.14 -137.5 0.04 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 52.25 -78.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.678 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -101.32 -4.6 26.74 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 177.631 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.46 ' N ' ' O ' ' A' ' 28' ' ' LEU . 6.3 m80 70.19 65.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.263 178.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.21 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.264 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.498 HH21 ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.08 -34.03 10.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.293 0.568 . . . . 0.0 109.654 179.472 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.498 ' CB ' HH21 ' A' ' 33' ' ' ARG . 96.5 p -176.51 -169.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.035 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -153.76 174.12 32.36 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.108 -1.044 . . . . 0.0 113.349 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.86 143.51 0.43 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.519 ' HB3' HD22 ' A' ' 45' ' ' LEU . 99.5 m -90.05 157.18 17.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.062 0.458 . . . . 0.0 111.985 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -147.24 142.28 27.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.851 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -86.29 173.19 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 111.618 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.584 ' C ' ' H ' ' A' ' 42' ' ' LYS . 29.1 p-10 -118.89 178.88 4.32 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.737 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.67 25.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.959 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.584 ' H ' ' C ' ' A' ' 40' ' ' ASP . 14.3 tppt? -145.26 -77.78 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.968 0.413 . . . . 0.0 109.932 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.614 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -179.12 12.57 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.29 179.762 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.433 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 0.6 OUTLIER -90.7 133.51 35.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.942 0.401 . . . . 0.0 110.673 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.519 HD22 ' HB3' ' A' ' 37' ' ' CYS . 6.4 mt -90.93 160.27 15.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -141.96 136.01 29.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.038 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.93 100.42 12.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.471 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.461 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.2 mp -89.62 116.41 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.594 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -94.78 119.26 33.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.652 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -94.07 123.17 37.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.571 0.7 . . . . 0.0 111.876 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.41 ' O ' ' HB2' ' A' ' 33' ' ' ARG . 11.8 m-85 -97.31 -94.43 0.22 Allowed 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.563 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.007 178.942 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.08 126.96 11.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.883 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.57 137.24 16.94 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.486 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.64 146.65 11.82 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.155 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.492 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.5 t80 -73.36 -16.12 61.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.361 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.642 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 88.23 143.34 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.643 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.493 ' C ' ' O ' ' A' ' 9' ' ' GLU . 13.6 t-20 15.33 46.61 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.926 0.766 . . . . 0.0 112.508 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.642 ' N ' ' O ' ' A' ' 9' ' ' GLU . 39.0 t80 -59.05 122.6 64.17 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.892 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -41.43 86.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.944 1.763 . . . . 0.0 112.031 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.55 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -53.17 97.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.039 0.447 . . . . 0.0 111.392 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -177.59 -82.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.333 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -68.71 99.33 1.0 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.601 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.552 ' HB3' HD12 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -172.59 105.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.494 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 169.37 36.11 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -166.6 145.29 5.44 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.887 0.375 . . . . 0.0 111.103 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.63 55.32 0.01 OUTLIER 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.237 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.601 ' N ' ' O ' ' A' ' 18' ' ' LEU . 7.1 t-20 -148.75 -115.06 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.604 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.554 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.2 mp0 3.41 -79.76 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 123.74 0.65 . . . . 0.0 112.241 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -56.11 26.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.928 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.7 OUTLIER -53.12 -61.26 2.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.319 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.537 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.45 -54.52 26.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.363 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.0 m-20 -51.35 -66.42 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.315 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.537 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.6 m -47.23 -43.92 22.24 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.94 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -59.48 8.71 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.924 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.9 tp -164.28 -36.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.942 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.482 ' N ' ' O ' ' A' ' 25' ' ' ASP . 15.4 m-20 -70.23 -21.42 63.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.862 0.363 . . . . 0.0 110.875 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' CG ' ' OH ' ' A' ' 51' ' ' TYR . 3.8 tptp -136.11 5.69 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.061 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.53 31.91 20.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.795 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.695 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.33 -177.73 6.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.93 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -99.08 -23.88 15.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.637 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 p -175.06 -165.32 0.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.864 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.53 -175.7 46.57 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.55 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -175.96 146.44 0.7 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.928 0.394 . . . . 0.0 111.316 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.24 105.83 18.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.462 ' CD2' HD12 ' A' ' 48' ' ' ILE . 41.0 m-85 -99.85 125.19 45.77 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.003 0.43 . . . . 0.0 112.082 -179.168 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.615 ' CE1' HD22 ' A' ' 45' ' ' LEU . 74.6 m-85 -73.98 174.36 8.7 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.103 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 3.0 p30 -173.52 156.15 2.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.748 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.478 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.2 pt-20 16.45 -74.53 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.872 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -99.09 45.43 1.0 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.382 -179.148 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.572 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 23.5 66.0 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.808 179.612 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.91 ' C ' HD23 ' A' ' 45' ' ' LEU . 4.6 m-20 -97.75 -3.76 38.42 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.415 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.91 HD23 ' C ' ' A' ' 44' ' ' ASN . 1.2 pt? 36.74 93.83 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.21 0.529 . . . . 0.0 112.018 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mp0 -94.12 138.11 32.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.803 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.449 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -77.0 98.11 4.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.809 -178.858 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.462 HD12 ' CD2' ' A' ' 38' ' ' PHE . 5.5 mt -86.51 114.56 26.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.708 179.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 65.6 m -91.31 117.73 29.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.467 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.695 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 6.6 t70 -95.26 127.83 41.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.0 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.454 ' OH ' ' CG ' ' A' ' 30' ' ' LYS . 39.4 m-85 -97.47 4.82 50.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.727 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.408 . . . . 0.0 110.435 179.465 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.14 0 CA-C-O 120.881 0.372 . . . . 0.0 110.767 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.8 141.04 27.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.976 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 134.68 24.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.958 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -61.48 131.67 26.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.681 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.6 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -67.14 -3.03 6.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.498 ' O ' ' O ' ' A' ' 10' ' ' ASN . 4.9 mt-10 90.46 -123.41 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.905 0.753 . . . . 0.0 110.398 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.569 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 10.5 m120 -53.47 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.269 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.569 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 24.1 t80 102.29 137.94 0.01 OUTLIER Pre-proline 0 N--CA 1.47 0.55 0 O-C-N 123.73 0.644 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.58 83.95 1.66 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.096 1.864 . . . . 0.0 112.226 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.435 ' CG1' HD23 ' A' ' 45' ' ' LEU . 3.0 t -52.61 106.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.002 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.6 p -173.51 -80.17 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.928 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -65.99 -17.79 64.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.911 0.386 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.497 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -65.15 84.07 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.46 179.832 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.2 mm-40 -132.85 -11.39 3.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.316 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.8 mt -165.48 167.08 17.87 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.935 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.541 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -57.28 137.1 56.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.58 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.554 ' CG ' ' N ' ' A' ' 21' ' ' GLN . 1.6 t-20 150.45 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.257 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.554 ' N ' ' CG ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -50.03 -55.18 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.217 179.847 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.0 t -59.45 -54.62 44.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -52.11 -67.84 0.22 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.762 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.558 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.11 -46.65 53.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.963 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.1 m-20 -49.2 -61.24 2.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.533 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.497 ' C ' ' H ' ' A' ' 28' ' ' LEU . 92.2 m -55.03 -42.73 72.98 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.587 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -60.17 7.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.323 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.2 tp -164.42 -20.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 25' ' ' ASP . 2.0 m-20 -68.27 -64.52 0.85 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.781 0.324 . . . . 0.0 110.648 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mttp -101.06 12.66 37.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.65 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.8 m170 68.3 39.35 2.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.194 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -87.72 -177.04 5.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.907 0.384 . . . . 0.0 111.323 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.67 -37.74 11.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.502 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.582 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.7 p -177.64 -140.33 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.627 0.251 . . . . 0.0 110.786 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.582 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 124.53 -159.31 19.16 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.727 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.77 171.8 2.18 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.35 131.83 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 111.567 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.502 ' O ' HD12 ' A' ' 45' ' ' LEU . 70.4 m-85 -149.42 -171.19 3.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.241 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.595 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 6.6 m-85 -90.65 141.61 28.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.944 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.572 ' C ' ' H ' ' A' ' 42' ' ' LYS . 1.3 p-10 -99.3 171.2 8.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.356 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -64.19 36.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.382 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.572 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.6 OUTLIER -143.01 8.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.057 0.456 . . . . 0.0 110.316 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' C ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 59.93 58.86 2.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.571 -179.726 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 2.3 m120 -143.82 -138.18 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.056 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.636 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 27.0 tp -155.12 129.25 8.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.88 0.372 . . . . 0.0 111.414 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.636 ' NE2' ' O ' ' A' ' 45' ' ' LEU . 3.3 mp0 -145.76 175.81 10.12 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.214 0.531 . . . . 0.0 111.105 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.414 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -95.25 103.47 15.33 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.092 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.3 mm -83.2 113.1 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 111.011 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -95.91 125.42 40.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.433 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.57 ' OD1' ' N ' ' A' ' 51' ' ' TYR . 61.5 t0 -94.29 143.09 26.69 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.503 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.57 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 81.7 m-85 -129.32 31.33 4.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.302 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.5 m . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.891 0.376 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -138.76 127.37 23.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.194 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -144.87 110.02 5.15 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.101 0.477 . . . . 0.0 111.417 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.5 m -69.36 143.49 14.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.522 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.517 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.7 OUTLIER -89.86 71.76 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.002 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.94 71.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.321 -178.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.531 ' O ' ' C ' ' A' ' 11' ' ' TYR . 28.9 t-20 177.94 -79.16 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.536 179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.548 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.3 t80 -0.42 114.4 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.448 0 O-C-N 123.915 0.759 . . . . 0.0 112.438 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.431 ' O ' ' N ' ' A' ' 14' ' ' SER . 86.8 Cg_exo -44.11 98.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.442 ' H ' HG23 ' A' ' 13' ' ' VAL . 2.0 t -54.29 87.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.933 0.396 . . . . 0.0 111.131 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.453 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 1.7 p -176.2 139.44 0.36 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.557 ' C ' ' H ' ' A' ' 17' ' ' GLN . 0.5 OUTLIER 84.2 8.54 0.52 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -67.95 21.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.814 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.557 ' H ' ' C ' ' A' ' 15' ' ' LYS . 1.6 mp0 -94.93 18.27 12.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 mt -166.96 147.03 5.56 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.012 0.434 . . . . 0.0 111.18 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.444 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.52 -178.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.967 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.615 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.5 OUTLIER 80.22 -72.42 0.07 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.757 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 2.0 mp0 -54.91 77.07 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.359 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ASN . 66.8 m 125.98 -54.29 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.601 1.16 . . . . 0.0 109.04 -178.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -55.16 -54.91 37.24 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.453 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -56.18 -53.86 52.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.977 178.66 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -46.73 -51.84 15.28 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.731 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.914 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 55.6 m -59.31 -43.45 92.65 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -58.08 4.16 0.02 OUTLIER 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.583 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.645 ' O ' ' N ' ' A' ' 30' ' ' LYS . 6.7 tp -164.8 -124.99 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.075 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 36.88 -81.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.73 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.645 ' N ' ' O ' ' A' ' 28' ' ' LEU . 2.2 mptp? -92.78 14.92 15.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.936 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.582 ' N ' ' O ' ' A' ' 28' ' ' LEU . 22.3 m170 62.97 49.71 3.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.862 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.914 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -90.37 -173.29 3.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.83 0.348 . . . . 0.0 110.586 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -114.3 -31.77 6.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.828 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.9 p -165.99 -168.11 1.2 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.41 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . 160.68 175.22 31.45 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.353 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -176.77 176.38 1.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 111.007 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.0 m -88.27 136.92 32.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.856 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -143.19 131.22 21.75 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.843 0.354 . . . . 0.0 111.664 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.571 ' CZ ' HD22 ' A' ' 45' ' ' LEU . 10.2 m-85 -72.42 166.82 21.82 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.476 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.405 ' OD1' ' N ' ' A' ' 44' ' ' ASN . 1.3 p30 -139.99 179.27 6.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.99 -14.78 51.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.49 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.95 5.98 49.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.988 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 18.6 ttp180 62.65 53.72 2.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.722 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.405 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 10.0 m-80 -143.95 135.55 26.04 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.962 ' H ' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -92.1 104.85 17.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.09 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 137.86 32.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.561 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 21.1 m -82.53 104.51 12.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.105 0.478 . . . . 0.0 110.884 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.41 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 17.1 mt -87.03 124.4 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.779 -178.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -98.37 113.84 25.96 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.944 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -93.45 154.93 17.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.013 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.6 -33.4 2.54 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.15 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.33 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.293 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.429 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 2.1 m . . . . . 0 CA--C 1.528 0.099 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -93.68 133.22 37.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.554 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.16 127.34 13.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 111.074 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.4 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.8 OUTLIER -66.58 146.04 13.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.9 OUTLIER -70.51 90.53 0.74 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.62 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -62.29 74.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.241 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.62 ' ND2' ' O ' ' A' ' 9' ' ' GLU . 20.2 p30 125.15 118.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.728 1.211 . . . . 0.0 109.968 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 42.1 t80 178.56 140.22 0.26 Allowed Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.318 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.7 73.66 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.145 1.897 . . . . 0.0 112.43 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.42 ' H ' HG23 ' A' ' 13' ' ' VAL . 3.0 t -55.38 99.75 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.874 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.0 p -175.89 -66.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.914 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -65.57 -3.92 5.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.967 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.42 83.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.107 0.48 . . . . 0.0 110.631 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.652 ' H ' HD12 ' A' ' 18' ' ' LEU . 40.1 mt-30 -145.87 22.78 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.296 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.887 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -164.42 129.73 2.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.076 0.465 . . . . 0.0 110.447 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.27 74.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.905 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.607 ' O ' ' N ' ' A' ' 23' ' ' ASN . 12.5 t-20 -162.39 -113.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.526 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.556 ' C ' ' O ' ' A' ' 20' ' ' ASN . 2.2 mp0 -3.18 -78.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.719 0.637 . . . . 0.0 112.098 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.6 t -58.89 -54.35 48.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 110.786 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' ASN . 60.3 t30 -52.17 -64.85 0.68 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.232 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.479 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.54 -41.9 61.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.257 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.441 ' OD1' ' O ' ' A' ' 21' ' ' GLN . 1.5 m-20 -54.39 -71.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.13 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.458 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -51.97 -32.18 32.32 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.248 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -59.57 0.2 0.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.396 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.458 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.8 tt -164.93 -26.72 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.717 0.294 . . . . 0.0 111.667 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -69.37 -52.59 25.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 110.822 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.88 11.72 34.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.492 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.8 m170 62.11 33.22 17.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.886 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.2 -179.79 6.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -29.59 13.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 110.398 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.5 p -179.13 -169.94 0.16 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.141 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 169.13 179.77 41.33 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.334 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -175.68 153.62 1.45 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -88.67 137.06 32.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.838 0.352 . . . . 0.0 111.212 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -147.56 152.45 37.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.45 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -57.08 -173.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.855 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 26.4 p-10 -170.75 85.07 0.1 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 40' ' ' ASP . 4.8 pt-20 30.56 27.8 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.821 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 1.5 mtpt -148.59 6.11 0.72 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.727 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 66.55 -2.82 0.97 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.128 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 42' ' ' LYS . 7.8 m-80 -95.42 140.34 30.43 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.12 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.718 ' N ' HD12 ' A' ' 45' ' ' LEU . 2.3 mp -78.97 155.42 28.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.666 0.745 . . . . 0.0 112.778 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.433 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -142.95 132.95 24.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.105 179.2 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.7 m -75.52 98.57 3.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.512 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.8 mp -86.66 107.39 16.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.36 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.3 m -97.97 119.19 36.15 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.819 0.343 . . . . 0.0 111.278 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -93.86 129.91 40.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -95.59 -32.65 12.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.054 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.429 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.499 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.53 0.176 0 CA-C-O 120.738 0.304 . . . . 0.0 111.186 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.481 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -144.51 158.26 43.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.424 179.688 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.48 119.29 6.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.042 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.68 HG23 ' H ' ' A' ' 9' ' ' GLU . 2.9 m -63.29 139.22 21.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.905 0.383 . . . . 0.0 110.985 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.544 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 28.5 t80 -51.06 -5.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.808 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.68 ' H ' HG23 ' A' ' 7' ' ' VAL . 28.0 mt-10 91.15 6.79 0.07 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.368 0.667 . . . . 0.0 111.39 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.583 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 52.5 t-20 113.47 74.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.1 0.875 . . . . 0.0 111.669 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 22' ' ' CYS . 4.1 t80 -54.11 144.05 40.76 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.532 ' O ' ' C ' ' A' ' 13' ' ' VAL . 19.7 Cg_endo -60.13 40.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.194 1.929 . . . . 0.0 112.678 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 11' ' ' TYR . 76.9 t 8.15 81.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 123.325 0.65 . . . . 0.0 112.598 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.5 p -175.77 20.8 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -172.05 101.74 0.17 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.163 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.8 OUTLIER -170.95 1.77 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.55 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.499 ' O ' HD12 ' A' ' 18' ' ' LEU . 19.3 mt-30 -78.16 50.95 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.064 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.639 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 2.2 mp -165.22 -114.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.773 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.639 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 165.67 46.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 0.0 110.703 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 21' ' ' GLN . 21.4 t30 -137.9 -63.62 0.56 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.49 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 24.4 tp60 -39.83 -72.23 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.866 0.365 . . . . 0.0 110.601 -179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 5.1 m -62.68 -45.18 93.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -50.34 -67.31 0.27 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.579 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.529 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.83 -50.82 55.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -43.39 -57.27 3.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.903 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 76.1 m -58.55 -45.33 89.15 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -57.05 0.48 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.508 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.794 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.1 tp -165.54 -131.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.501 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 35.3 -68.69 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 123.675 0.609 . . . . 0.0 112.481 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.794 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -87.47 -5.43 58.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.983 0.42 . . . . 0.0 110.098 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.547 ' N ' ' O ' ' A' ' 28' ' ' LEU . 1.6 m170 79.17 36.3 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.039 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.903 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.89 -179.69 5.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.578 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 53.0 mtt-85 -99.55 -28.75 13.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.228 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.5 p -175.95 -159.67 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.519 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.92 -176.16 41.38 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.936 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -176.34 158.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.819 0.342 . . . . 0.0 110.495 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.6 m -88.88 147.91 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.215 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -139.3 132.24 29.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.747 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.496 ' CE2' HD12 ' A' ' 45' ' ' LEU . 48.7 m-85 -89.78 139.21 30.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.91 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.599 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -93.48 76.42 4.44 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.096 0.474 . . . . 0.0 110.783 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' A' ' 40' ' ' ASP . 2.3 pt-20 19.02 44.94 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.631 -1.168 . . . . 0.0 112.114 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.9 mtpm? -142.3 -65.83 0.4 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.554 ' CG ' ' O ' ' A' ' 42' ' ' LYS . 2.3 mmm180 167.79 -21.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.915 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -87.98 172.35 9.63 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.772 HD13 ' N ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -149.53 168.97 22.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.497 0.665 . . . . 0.0 112.527 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -135.92 141.57 44.54 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.346 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 90.3 m -92.6 103.43 15.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.108 -179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 57.7 mt -84.54 120.17 34.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.614 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.1 m -92.76 116.1 28.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -90.76 120.77 32.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.244 0.545 . . . . 0.0 111.121 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.578 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 66.5 m-85 -97.81 13.62 29.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.654 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 73.0 m . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.913 -179.905 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.151 0 CA-C-O 120.679 0.276 . . . . 0.0 111.382 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.26 134.26 19.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.808 0.337 . . . . 0.0 110.674 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.97 131.8 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.443 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -64.55 141.57 18.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -44.52 -85.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.512 ' O ' ' N ' ' A' ' 11' ' ' TYR . 2.0 mt-10 -178.07 -155.3 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.702 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.56 ' O ' ' C ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -39.17 -25.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.562 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.684 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 2.3 t80 1.67 91.68 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.86 0.725 . . . . 0.0 111.685 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.519 ' O ' ' C ' ' A' ' 13' ' ' VAL . 60.6 Cg_endo -74.14 59.16 4.45 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 121.836 1.69 . . . . 0.0 112.269 -179.246 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.756 HG22 ' N ' ' A' ' 14' ' ' SER . 7.3 p 6.83 -119.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.452 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.756 ' N ' HG22 ' A' ' 13' ' ' VAL . 1.4 p 84.83 -2.78 0.93 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.039 0.447 . . . . 0.0 110.06 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.436 ' CG ' ' C ' ' A' ' 14' ' ' SER . 2.4 mttt -164.41 108.7 0.95 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.327 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -172.67 97.7 0.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.046 0.451 . . . . 0.0 111.142 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.483 ' CG ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mt-30 -172.71 23.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.304 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.82 146.33 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.525 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.26 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.133 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.58 ' O ' ' N ' ' A' ' 23' ' ' ASN . 66.3 t30 -173.8 -132.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.061 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.529 ' C ' ' O ' ' A' ' 20' ' ' ASN . 13.4 mm-40 8.32 -87.43 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.979 0.8 . . . . 0.0 112.379 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 39.6 m -53.46 -56.68 14.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.955 0.407 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.58 ' N ' ' O ' ' A' ' 20' ' ' ASN . 2.5 t30 -52.46 -64.79 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.488 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -51.91 -50.97 60.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.135 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' A' ' 29' ' ' ASP . 67.8 m-20 -51.39 -60.27 3.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.889 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.445 ' C ' ' H ' ' A' ' 28' ' ' LEU . 66.9 m -54.51 -41.38 69.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.037 0.446 . . . . 0.0 110.169 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.516 ' HA ' ' HZ3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -59.48 3.75 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.17 -179.608 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.9 tt -163.27 -36.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.285 -0.566 . . . . 0.0 112.324 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 25' ' ' ASP . 85.4 m-20 -68.07 -44.07 77.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.801 0.334 . . . . 0.0 110.662 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.6 10.73 26.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m80 42.37 48.21 4.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.059 0.457 . . . . 0.0 110.008 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.582 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -85.97 -177.69 6.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.655 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.597 ' NE ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -101.67 -30.11 11.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.046 0.45 . . . . 0.0 110.343 179.851 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.584 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.2 OUTLIER -172.99 155.19 3.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.278 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.484 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 165.04 175.17 35.51 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.547 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 38' ' ' PHE . 10.8 pt-20 -178.2 -162.64 0.06 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.781 0.324 . . . . 0.0 110.734 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -87.06 129.22 35.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.279 179.475 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 36' ' ' GLU . 34.7 m-85 -147.05 167.07 24.98 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.334 0.587 . . . . 0.0 111.857 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.695 ' CE1' HD13 ' A' ' 45' ' ' LEU . 65.0 m-85 -98.17 -117.59 0.14 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.801 178.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.526 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.1 OUTLIER 51.4 149.55 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.42 0.629 . . . . 0.0 112.014 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.471 ' CG ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 89.41 -56.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.474 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.473 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 1.9 ttmt -149.63 30.61 0.74 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 54.72 18.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.995 0.426 . . . . 0.0 110.311 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.473 ' OD1' ' O ' ' A' ' 42' ' ' LYS . 6.6 m-20 -95.75 125.5 40.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.697 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.695 HD13 ' CE1' ' A' ' 39' ' ' TYR . 6.6 tp -85.78 112.4 21.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.813 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -142.22 161.32 38.31 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 112.23 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.684 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 73.0 m -75.62 96.66 3.6 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.873 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.3 mt -90.27 117.17 33.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.358 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 59.7 m -93.48 110.53 22.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.038 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' SER . 0.9 OUTLIER -93.1 160.67 14.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.786 0.803 . . . . 0.0 112.265 -178.993 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 4' ' ' CYS . 87.4 m-85 -128.35 -28.41 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.209 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.749 179.7 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.532 0.262 0 CA-C-O 120.641 0.258 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.85 154.87 43.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.726 0.298 . . . . 0.0 110.765 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -151.12 121.14 7.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.293 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -63.06 116.35 2.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.564 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -55.52 76.45 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.129 -179.476 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 7' ' ' VAL . 50.5 mt-10 8.81 117.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.511 ' C ' ' O ' ' A' ' 9' ' ' GLU . 6.0 m-20 14.47 52.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.613 ' O ' ' N ' ' A' ' 13' ' ' VAL . 87.4 t80 -54.6 136.61 62.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.414 ' HD2' ' CD1' ' A' ' 11' ' ' TYR . 76.6 Cg_exo -40.43 84.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 121.852 1.701 . . . . 0.0 111.768 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -56.61 106.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.53 -179.061 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 89.2 p -175.75 -86.55 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.06 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.785 ' CB ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -69.59 159.28 33.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.949 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.581 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.0 m -170.58 -79.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.678 0.275 . . . . 0.0 111.393 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' LEU . 2.4 mp0 63.08 13.22 6.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.151 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.62 HD12 ' N ' ' A' ' 18' ' ' LEU . 4.4 mp 28.38 57.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.325 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 173.86 35.53 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.03 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.574 ' O ' ' N ' ' A' ' 23' ' ' ASN . 50.3 t30 -174.5 -118.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.785 HE21 ' CB ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -1.01 -83.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.997 0.811 . . . . 0.0 112.209 179.534 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 0.3 OUTLIER -58.57 -50.78 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.256 -179.755 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 20' ' ' ASN . 10.2 t-20 -51.55 -69.04 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.931 0.396 . . . . 0.0 110.51 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.47 -47.12 66.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.935 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 29' ' ' ASP . 94.9 m-20 -56.9 -67.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.602 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 28' ' ' LEU . 4.3 m -50.42 -40.52 50.46 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.227 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -58.91 5.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.665 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.649 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.2 tm? -163.46 -40.92 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.878 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 25' ' ' ASP . 32.4 m-20 -68.21 -53.07 27.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.746 0.307 . . . . 0.0 111.298 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -99.74 18.63 17.68 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.904 0.383 . . . . 0.0 111.097 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 41.46 35.65 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.886 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.502 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.44 -171.91 3.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.16 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -95.17 -48.0 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.825 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.476 ' O ' ' OD2' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -163.48 145.8 9.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.076 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.4 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -114.91 178.21 17.79 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.895 -0.669 . . . . 0.0 113.314 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.4 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 4.8 mt-10 -174.66 139.98 0.57 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -88.78 145.28 25.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 0.0 110.896 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -144.04 142.16 30.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.929 0.395 . . . . 0.0 110.718 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.535 ' CE2' HD21 ' A' ' 45' ' ' LEU . 63.2 m-85 -72.21 -177.7 2.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.866 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.589 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.3 OUTLIER 163.35 -172.2 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.419 0.628 . . . . 0.0 111.195 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.8 OUTLIER 24.95 -82.23 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.143 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.604 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 26.2 mmtt -134.26 79.29 1.8 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.831 0.348 . . . . 0.0 111.645 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 46.65 28.38 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.121 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.604 ' OD1' ' N ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -94.44 122.83 37.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.622 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.535 HD21 ' CE2' ' A' ' 39' ' ' TYR . 12.1 mt -89.08 109.11 20.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.685 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -93.22 135.84 34.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.657 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.487 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.3 m -77.21 100.97 5.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -86.78 116.73 29.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.556 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 99.2 m -93.76 111.47 23.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.865 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.502 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -88.0 143.32 27.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.524 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -112.46 -3.9 14.34 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.86 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.9 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.741 0.305 . . . . 0.0 110.761 -179.921 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.536 0.405 0 CA-C-O 120.863 0.364 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -146.01 139.17 25.92 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.032 0.444 . . . . 0.0 111.55 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.432 ' NZ ' ' OH ' ' A' ' 51' ' ' TYR . 25.8 pttt -151.77 140.72 21.08 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.754 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.66 HG12 ' NE2' ' A' ' 46' ' ' GLN . 0.8 OUTLIER -59.98 154.94 3.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 121.22 0.533 . . . . 0.0 111.818 -178.975 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.714 ' CE2' ' CZ ' ' A' ' 11' ' ' TYR . 57.1 t80 -91.05 -16.77 27.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.602 -178.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.53 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 22.48 110.97 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.367 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 11' ' ' TYR . 1.4 t-20 170.27 -71.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 177.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.714 ' CZ ' ' CE2' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -46.72 173.54 0.04 OUTLIER Pre-proline 0 C--O 1.231 0.087 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.708 179.73 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.74 ' O ' HG12 ' A' ' 13' ' ' VAL . 16.7 Cg_exo -66.05 -14.84 46.28 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.358 1.372 . . . . 0.0 110.189 178.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.74 HG12 ' O ' ' A' ' 12' ' ' PRO . 1.9 p 103.94 -20.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.224 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.78 -33.67 75.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.682 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -69.19 147.26 51.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 110.57 179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.47 ' SG ' HD22 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -175.55 -75.74 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 -179.887 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 49.56 29.91 3.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.2 0.524 . . . . 0.0 110.072 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.3 mt 44.69 -133.45 0.75 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.408 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.23 80.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.562 ' O ' ' N ' ' A' ' 22' ' ' CYS . 50.5 t30 -176.83 -117.14 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.902 0.382 . . . . 0.0 111.69 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.591 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 1.5 tp-100 -57.73 54.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 112.277 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.591 ' SG ' ' O ' ' A' ' 21' ' ' GLN . 1.7 m 177.8 -58.79 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 -59.19 -52.0 67.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -48.9 78.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.879 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.499 ' OD1' ' N ' ' A' ' 22' ' ' CYS . 3.7 m-20 -52.8 -53.91 41.63 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.348 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 28' ' ' LEU . 71.7 m -53.39 -46.62 69.75 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 13.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.511 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 26' ' ' CYS . 52.7 tp -165.27 -36.37 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.415 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -68.62 -44.43 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.623 0.249 . . . . 0.0 111.021 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.471 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 42.2 mmtt -107.79 -0.16 21.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.195 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.471 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 75.78 35.7 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -87.13 177.39 7.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.213 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -107.43 -5.37 17.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.577 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.406 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER 174.39 -169.26 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.365 -179.815 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -173.65 -165.03 29.8 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.636 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.502 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 2.0 mt-10 -176.44 -164.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 110.366 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.4 m -144.17 132.35 21.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.628 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.788 ' CD2' HD12 ' A' ' 48' ' ' ILE . 97.8 m-85 -146.62 169.86 18.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.071 0.462 . . . . 0.0 111.531 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.614 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.0 m-85 -100.84 120.15 39.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.639 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.681 ' O ' ' N ' ' A' ' 42' ' ' LYS . 5.3 p-10 -122.65 123.38 41.02 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 40' ' ' ASP . 15.2 tt0 21.74 35.17 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.855 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.681 ' N ' ' O ' ' A' ' 40' ' ' ASP . 19.4 mtmm -147.1 -6.24 0.5 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.687 0.279 . . . . 0.0 111.34 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 31.6 mmt-85 57.56 10.08 0.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.008 0.432 . . . . 0.0 110.049 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 10.2 m-20 -94.73 -130.91 0.15 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.303 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.682 ' O ' HG22 ' A' ' 13' ' ' VAL . 2.3 mt -152.95 95.17 1.94 Allowed 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.66 ' NE2' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -89.7 156.1 18.77 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 178.702 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 13.3 m -106.65 115.18 29.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.062 0.458 . . . . 0.0 111.292 -178.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.788 HD12 ' CD2' ' A' ' 38' ' ' PHE . 23.0 mt -88.93 132.29 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.727 -178.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 92.1 m -100.38 112.47 24.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.005 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.471 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.4 OUTLIER -94.24 140.51 29.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.203 0.525 . . . . 0.0 111.302 -179.473 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.432 ' OH ' ' NZ ' ' A' ' 6' ' ' LYS . 71.7 m-85 -113.46 -24.91 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.167 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.174 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.17 0 CA-C-O 120.715 0.293 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -118.11 134.14 55.27 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.858 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -149.22 125.49 10.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.998 0.428 . . . . 0.0 111.27 179.401 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.33 144.27 14.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.434 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.51 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.5 t80 -84.68 61.89 7.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.926 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.637 ' O ' ' N ' ' A' ' 11' ' ' TYR . 4.1 mm-40 32.94 -159.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.625 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -58.73 44.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.207 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.637 ' N ' ' O ' ' A' ' 9' ' ' GLU . 7.0 t80 -52.92 134.41 48.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.552 ' C ' ' H ' ' A' ' 14' ' ' SER . 84.6 Cg_exo -39.32 85.54 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.156 1.904 . . . . 0.0 112.475 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' TYR . 9.6 p -57.48 1.3 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.401 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.552 ' H ' ' C ' ' A' ' 12' ' ' PRO . 35.7 p -62.94 -95.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.286 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.66 113.79 5.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.007 0.432 . . . . 0.0 111.447 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -175.06 108.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.205 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -143.24 -23.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.674 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.13 -178.94 4.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 110.961 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.43 112.1 1.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.57 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.558 ' ND2' ' OE1' ' A' ' 21' ' ' GLN . 49.3 t-20 -175.55 -105.66 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.782 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.558 ' OE1' ' ND2' ' A' ' 20' ' ' ASN . 9.6 mm100 -50.05 -55.89 12.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.851 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.7 t -55.7 -57.38 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.26 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -51.45 -64.88 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.874 0.368 . . . . 0.0 110.625 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.552 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.69 -47.03 64.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.326 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.555 ' O ' ' N ' ' A' ' 29' ' ' ASP . 20.1 m-20 -52.12 -64.71 0.73 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.5 ' C ' ' H ' ' A' ' 28' ' ' LEU . 89.9 m -51.32 -50.32 59.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -61.87 14.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.712 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.3 tm? -163.73 -41.01 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.265 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.555 ' N ' ' O ' ' A' ' 25' ' ' ASP . 3.5 m-20 -67.43 -47.61 69.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.1 mtpm? -101.25 6.53 42.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.829 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 58.15 36.66 26.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.535 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.75 -174.77 5.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.038 0.447 . . . . 0.0 111.467 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.4 tpt85 -93.87 -25.96 17.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.7 p -176.35 -164.11 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.287 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 159.83 176.02 31.45 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.792 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -177.0 164.43 2.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 0.0 110.437 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 136.82 33.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.872 0.368 . . . . 0.0 110.519 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -146.73 162.16 39.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 23.0 m-85 -86.07 175.95 8.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.03 0.443 . . . . 0.0 111.462 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.595 ' C ' ' H ' ' A' ' 42' ' ' LYS . 17.9 p-10 -109.41 173.21 6.42 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.322 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' OE1' ' N ' ' A' ' 41' ' ' GLU . 53.0 mp0 -65.14 27.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.673 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.595 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 -74.15 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.571 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.467 ' O ' ' CG ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER 169.71 70.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.387 179.631 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 35.1 m120 -141.61 -155.42 0.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.428 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.55 137.05 21.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.807 0.337 . . . . 0.0 110.608 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -146.97 139.69 25.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.586 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -82.65 100.2 10.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.318 179.517 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.2 mm -82.89 112.58 20.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.556 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.7 m -95.76 117.51 30.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.227 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.505 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.1 OUTLIER -95.01 143.65 26.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.929 0.395 . . . . 0.0 110.727 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -114.23 -26.67 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.611 -179.062 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.2 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.743 0.306 . . . . 0.0 110.887 179.864 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.743 0.306 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.61 153.35 40.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.763 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -149.71 128.92 12.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.116 0.484 . . . . 0.0 111.638 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.409 HG12 HD11 ' A' ' 48' ' ' ILE . 5.6 m -64.34 146.3 13.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.615 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.75 76.96 7.15 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.559 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.5 pt-20 -61.58 82.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.416 -178.563 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 1.3 t-20 153.73 -2.82 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.286 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.639 ' CE1' ' SG ' ' A' ' 47' ' ' CYS . 3.9 t80 -55.83 129.43 71.64 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.632 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.535 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.4 Cg_exo -59.77 45.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 121.91 1.74 . . . . 0.0 113.256 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 11' ' ' TYR . 36.0 t 2.97 93.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 123.705 0.628 . . . . 0.0 112.665 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.504 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 85.1 p -171.22 -97.41 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.154 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.504 ' N ' ' OG ' ' A' ' 14' ' ' SER . 18.0 tttp -63.93 117.11 6.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.95 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -172.0 -12.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.019 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.41 ' H ' ' HG2' ' A' ' 17' ' ' GLN . 14.8 mm-40 -80.39 33.18 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.597 0.237 . . . . 0.0 110.79 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.4 ' H ' ' C ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -166.96 116.97 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.724 -179.672 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.77 99.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.654 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.9 t-20 -168.82 -86.78 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -45.55 -61.0 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.306 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.574 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.6 t -58.16 -54.46 46.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.43 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.593 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -51.03 -63.4 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.728 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.497 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.44 -47.94 62.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.243 179.312 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 29' ' ' ASP . 14.6 m-20 -50.81 -62.6 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.506 ' C ' ' H ' ' A' ' 28' ' ' LEU . 80.4 m -53.85 -41.4 67.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -59.99 7.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.063 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.506 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -162.36 -40.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.045 -179.375 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.506 ' N ' ' O ' ' A' ' 25' ' ' ASP . 71.8 m-20 -67.35 -54.28 21.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.767 0.318 . . . . 0.0 111.004 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 1.3 mmmm -102.25 29.9 4.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.888 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 7.9 m170 33.09 39.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.427 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.671 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -89.01 -176.11 5.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.678 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -95.92 -26.12 15.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.07 0.462 . . . . 0.0 110.458 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.451 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -175.17 -159.14 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.07 -179.972 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.593 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . 164.72 -172.0 40.32 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.978 -1.106 . . . . 0.0 113.456 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 4.9 tt0 -177.07 -144.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.914 0.388 . . . . 0.0 110.521 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.09 133.84 17.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.648 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -149.66 -177.96 6.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.222 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -90.31 -166.79 1.67 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.863 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.471 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -176.41 -173.07 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.612 -179.755 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -60.52 -2.57 0.52 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.399 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.528 ' C ' ' H ' ' A' ' 44' ' ' ASN . 6.0 mmtp -100.81 -1.43 34.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.086 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 59.47 -2.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.243 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.528 ' H ' ' C ' ' A' ' 42' ' ' LYS . 2.1 m120 -94.97 158.81 15.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.695 0.283 . . . . 0.0 110.749 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mt -87.84 133.2 33.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -146.5 157.2 43.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.187 0.518 . . . . 0.0 111.363 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.639 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -70.77 157.33 38.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.121 -179.72 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.409 HD11 HG12 ' A' ' 7' ' ' VAL . 0.9 OUTLIER -143.43 111.85 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.953 -179.819 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.8 m -92.22 119.0 31.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.887 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.671 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 1.7 t70 -92.7 158.39 15.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.441 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -129.92 -36.11 1.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 34.5 m . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.918 -179.748 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.8 m . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.895 0.378 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 138.4 26.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.939 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.556 ' C ' HG12 ' A' ' 7' ' ' VAL . 3.6 mtpm? -147.84 -156.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.128 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.556 HG12 ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -168.52 158.84 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.627 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.13 114.31 22.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.034 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -65.42 4.91 0.47 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.412 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.627 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 9.3 p30 178.23 136.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.727 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.6 t80 -179.42 100.92 0.19 Allowed Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.928 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.642 ' O ' ' N ' ' A' ' 14' ' ' SER . 80.7 Cg_exo -45.39 65.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.885 2.39 . . . . 0.0 113.624 -178.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.727 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.4 t 8.98 51.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 123.967 0.907 . . . . 0.0 113.297 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.642 ' N ' ' O ' ' A' ' 12' ' ' PRO . 2.8 p -68.7 135.64 51.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 0.0 111.915 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 26.66 32.37 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.579 ' N ' ' O ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -71.52 82.05 0.81 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.469 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -161.53 -42.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.977 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -73.06 -103.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.501 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.52 22.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.506 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.591 ' O ' ' N ' ' A' ' 22' ' ' CYS . 18.5 t-20 -114.59 -112.16 0.34 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.021 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.563 ' C ' ' O ' ' A' ' 20' ' ' ASN . 11.6 mm-40 0.89 -68.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.775 0.672 . . . . 0.0 111.827 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 42.7 t -60.94 -68.15 0.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.694 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.5 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.5 OUTLIER -47.17 -46.96 23.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.226 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.05 -48.97 78.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.096 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -52.37 -57.0 11.2 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.393 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.648 ' C ' ' H ' ' A' ' 28' ' ' LEU . 91.6 m -58.13 -44.05 87.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -61.43 11.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.54 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.699 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.2 tp -160.89 -134.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.071 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 40.41 -76.87 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.175 0.297 . . . . 0.0 111.77 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 28' ' ' LEU . 9.9 mmtp -90.6 -9.16 48.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 110.557 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.455 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 3.3 m170 79.91 49.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.206 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.642 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.92 -136.57 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.157 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -141.45 -53.63 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.665 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -155.92 133.34 10.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.641 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.45 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . -105.98 -157.19 22.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.5 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -172.14 131.54 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 87.2 m -90.36 123.3 33.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.724 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.442 ' CE1' HG13 ' A' ' 48' ' ' ILE . 23.2 p90 -149.16 140.7 23.39 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 120.513 -0.475 . . . . 0.0 112.017 -179.322 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.51 ' HA ' ' H ' ' A' ' 45' ' ' LEU . 59.5 m-85 -72.69 133.87 44.8 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.66 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 42' ' ' LYS . 13.1 p-10 -146.68 -166.13 2.41 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.458 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.488 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.4 tt0 22.23 42.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.186 -178.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.58 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.2 mtpt 68.96 83.05 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.207 178.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.4 ttp85 61.54 52.73 3.56 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.002 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.427 ' ND2' ' HB3' ' A' ' 41' ' ' GLU . 3.3 m-20 -93.34 -60.31 1.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.51 ' H ' ' HA ' ' A' ' 39' ' ' TYR . 11.9 tp 76.92 67.19 0.05 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.296 -178.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -91.87 -175.96 4.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.015 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -127.27 123.56 36.74 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.534 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -87.58 155.05 3.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.499 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.3 m -135.28 108.7 7.85 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.039 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -94.29 134.77 36.42 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -101.36 -24.67 14.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.93 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.1 m . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.019 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.231 0.083 0 CA-C-O 121.001 0.429 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.466 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -118.38 126.89 53.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.914 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.45 138.03 47.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.069 0.462 . . . . 0.0 111.787 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.739 HG23 ' H ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -61.41 146.98 11.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.62 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.609 ' CG ' ' O ' ' A' ' 8' ' ' TYR . 2.2 t80 -92.11 42.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.962 0.41 . . . . 0.0 110.429 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.739 ' H ' HG23 ' A' ' 7' ' ' VAL . 4.5 pt-20 17.83 76.96 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.031 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.543 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 7.3 m120 103.74 145.41 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.059 0.849 . . . . 0.0 110.827 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 13' ' ' VAL . 39.4 t80 -179.32 123.7 0.24 Allowed Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.421 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_exo -41.75 82.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.293 1.995 . . . . 0.0 112.733 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.575 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.1 t -55.21 95.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 p -175.26 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -26.3 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.101 0.477 . . . . 0.0 110.123 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.449 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -68.09 90.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.735 179.236 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.654 ' H ' HD12 ' A' ' 18' ' ' LEU . 30.2 mt-30 -158.29 21.4 0.24 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.652 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.916 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -165.69 -79.55 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.739 0.304 . . . . 0.0 111.044 -179.588 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -178.01 -159.83 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 -178.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.497 ' O ' ' N ' ' A' ' 24' ' ' TYR . 28.9 t-20 60.83 -72.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.381 -179.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.545 ' N ' ' O ' ' A' ' 19' ' ' ALA . 6.0 mm-40 -39.49 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.6 t -59.57 -46.41 88.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.704 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -54.25 -76.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.234 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.497 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.58 -43.33 35.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.467 179.926 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 29' ' ' ASP . 46.0 m-20 -50.37 -60.54 2.89 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.542 ' C ' ' H ' ' A' ' 28' ' ' LEU . 81.9 m -55.97 -39.53 71.94 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.275 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -59.69 7.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.836 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.542 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.8 tt -163.35 -26.07 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.638 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 25' ' ' ASP . 17.8 m-20 -70.03 -51.81 29.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 110.649 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 3.7 mmmm -110.21 0.24 18.1 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.969 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.402 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.2 OUTLIER 66.75 41.53 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.429 -179.594 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.535 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -85.83 -178.61 6.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.365 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -95.65 -10.57 29.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.071 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 174.67 -169.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.987 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.71 170.24 37.61 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.835 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.04 153.19 0.78 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -88.43 137.16 32.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.569 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -146.4 159.99 42.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -69.65 -168.64 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.612 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -161.64 156.69 23.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.461 0.648 . . . . 0.0 112.67 -179.782 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 40' ' ' ASP . 5.1 mm-40 11.73 -69.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.378 -1.283 . . . . 0.0 114.137 179.03 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -88.75 -57.1 3.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.388 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER 164.25 31.44 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.903 0.382 . . . . 0.0 110.02 -179.738 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -94.68 135.77 35.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.594 179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.586 HD13 ' N ' ' A' ' 46' ' ' GLN . 1.9 tm? -86.43 131.93 34.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.179 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.586 ' N ' HD13 ' A' ' 45' ' ' LEU . 38.1 mt-30 -142.25 165.47 27.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.543 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.458 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -97.19 103.69 15.65 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.413 -179.494 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.558 ' N ' HD13 ' A' ' 48' ' ' ILE . 1.9 mm -93.69 119.81 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.1 m -94.49 123.37 37.87 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.208 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.535 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 15.1 t70 -94.67 136.9 34.44 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.179 0.514 . . . . 0.0 111.373 -179.672 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -110.68 -9.61 14.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.56 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.7 m . . . . . 0 N--CA 1.463 0.219 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.039 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 62.9 m . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.759 0.314 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.15 118.95 37.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.451 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -149.82 115.8 5.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.053 0.454 . . . . 0.0 112.103 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.431 HG12 HG12 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -70.69 148.0 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 178.745 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.667 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -103.96 -7.44 20.37 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.027 179.58 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 8' ' ' TYR . 2.0 tm-20 30.23 104.82 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.105 -0.952 . . . . 0.0 112.095 -178.248 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.667 ' ND2' ' O ' ' A' ' 8' ' ' TYR . 3.0 p30 170.5 -44.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.264 179.003 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.478 ' CE2' ' OD2' ' A' ' 25' ' ' ASP . 55.0 t80 -53.62 139.37 49.98 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.737 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 14' ' ' SER . 94.5 Cg_exo -39.59 95.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.081 1.854 . . . . 0.0 112.058 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.2 p -53.02 -7.17 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 12' ' ' PRO . 96.9 p -65.25 -88.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.082 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.472 ' N ' ' OG ' ' A' ' 14' ' ' SER . 35.8 tptt -66.02 139.65 58.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.756 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.75 22.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.915 0.388 . . . . 0.0 110.974 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -113.77 57.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.185 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.593 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -168.88 124.99 0.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.96 54.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.552 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.593 ' N ' ' O ' ' A' ' 18' ' ' LEU . 11.3 t30 -159.82 -73.81 0.07 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.442 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.581 ' O ' ' CB ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -53.05 90.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.969 179.299 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.581 ' CB ' ' O ' ' A' ' 21' ' ' GLN . 52.3 t 120.61 -57.95 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.613 1.196 . . . . 0.0 109.878 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 0.1 OUTLIER -56.5 -54.7 42.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.031 0.443 . . . . 0.0 109.854 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.519 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -55.18 -48.2 74.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.185 179.147 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.595 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -53.09 -51.27 62.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.069 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.819 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 22.2 m -56.27 -44.31 79.64 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.6 tttp -60.76 12.27 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.132 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.648 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -162.16 -129.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.664 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.576 ' H ' HD12 ' A' ' 28' ' ' LEU . 0.4 OUTLIER 40.05 -81.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.706 0.289 . . . . 0.0 111.292 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.648 ' N ' ' O ' ' A' ' 28' ' ' LEU . 18.0 mttm -95.3 5.25 52.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.5 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.563 ' N ' ' O ' ' A' ' 28' ' ' LEU . 3.3 m170 71.94 56.47 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.819 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.58 177.53 6.52 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.494 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -96.78 -21.83 17.31 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.094 0.473 . . . . 0.0 109.864 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.494 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 1.5 p 158.59 137.86 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.049 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.439 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -128.67 -173.17 13.36 Favored Glycine 0 CA--C 1.51 -0.221 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.398 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -179.0 158.95 0.96 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 0.0 110.531 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.8 m -87.17 138.51 31.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.579 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -138.24 157.48 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.876 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.628 ' CE1' HD21 ' A' ' 45' ' ' LEU . 68.1 m-85 -93.22 -169.76 2.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.794 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.554 ' C ' ' H ' ' A' ' 42' ' ' LYS . 30.2 p30 -166.58 -172.3 2.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -65.04 18.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.827 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.554 ' H ' ' C ' ' A' ' 40' ' ' ASP . 12.3 mmtp -138.25 17.89 2.78 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.929 0.395 . . . . 0.0 111.043 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.11 13.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.463 179.214 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.404 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 91.2 m-20 -94.67 141.33 28.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.808 0.337 . . . . 0.0 111.166 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.628 HD21 ' CE1' ' A' ' 39' ' ' TYR . 16.7 mt -87.78 147.35 25.21 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.943 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.404 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 2.5 mp0 -147.05 134.49 20.8 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.29 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . 1.5 m -77.42 102.19 6.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.435 0.636 . . . . 0.0 112.391 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.431 HG12 HG12 ' A' ' 7' ' ' VAL . 5.0 mt -89.28 117.34 32.44 Favored 'Isoleucine or valine' 0 C--N 1.341 0.208 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.077 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.2 m -93.97 115.61 27.98 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 110.101 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.465 ' OD2' ' O ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.05 129.24 44.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.447 0.642 . . . . 0.0 110.597 179.754 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -102.38 -12.41 17.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.001 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.051 -179.981 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.2 m . . . . . 0 CA--C 1.527 0.062 0 CA-C-O 120.684 0.278 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.9 pttt -146.26 131.47 18.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.852 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -145.44 124.94 13.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.409 . . . . 0.0 111.088 -179.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.04 129.28 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.43 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.97 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.604 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 176.13 -173.43 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.556 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.723 ' O ' ' O ' ' A' ' 11' ' ' TYR . 4.3 p30 -19.51 -42.13 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.968 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.723 ' O ' ' O ' ' A' ' 10' ' ' ASN . 59.1 t80 20.15 131.11 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.588 ' C ' ' H ' ' A' ' 14' ' ' SER . 49.0 Cg_endo -67.62 102.35 0.72 Allowed 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.98 1.787 . . . . 0.0 112.624 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.517 ' O ' HG12 ' A' ' 13' ' ' VAL . 9.3 t -59.83 10.83 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.767 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.588 ' H ' ' C ' ' A' ' 12' ' ' PRO . 95.7 p -61.0 -5.58 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.173 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.599 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -166.78 127.85 1.65 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.016 0.436 . . . . 0.0 111.211 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 60.9 m -166.42 11.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.76 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.4 8.13 41.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.518 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.645 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -159.51 136.98 9.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.21 0.528 . . . . 0.0 110.495 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.734 ' HB1' HD22 ' A' ' 23' ' ' ASN . . . -59.41 113.85 2.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.667 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.519 ' O ' ' C ' ' A' ' 21' ' ' GLN . 56.6 t-20 -175.83 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.844 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.519 ' C ' ' O ' ' A' ' 20' ' ' ASN . 72.0 tp60 -16.34 -74.37 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.92 0.763 . . . . 0.0 112.009 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.3 t -57.98 -49.25 77.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.734 HD22 ' HB1' ' A' ' 19' ' ' ALA . 44.8 t-20 -53.8 -69.56 0.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.144 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -38.96 32.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.562 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 29' ' ' ASP . 13.9 m-20 -55.45 -63.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.394 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.47 ' C ' ' H ' ' A' ' 28' ' ' LEU . 16.4 m -56.38 -38.95 72.15 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.57 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.196 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.647 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.3 tm? -163.24 -41.17 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.5 -0.48 . . . . 0.0 112.046 -179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.551 ' N ' ' O ' ' A' ' 25' ' ' ASP . 96.6 m-20 -68.26 -16.44 63.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 110.895 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -143.33 22.69 1.85 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.237 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 40.74 39.58 0.8 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.11 0.481 . . . . 0.0 111.131 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.37 -173.79 4.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.846 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.55 -40.74 9.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.229 0.537 . . . . 0.0 110.494 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -161.28 175.46 12.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.686 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -158.77 146.58 13.33 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.408 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -175.73 156.52 1.86 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.419 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 2.8 m -88.38 145.19 25.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.432 0.634 . . . . 0.0 112.553 -178.393 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -143.3 163.37 33.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.437 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.4 166.75 22.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.707 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.487 ' O ' ' C ' ' A' ' 41' ' ' GLU . 2.1 p30 -171.53 176.11 3.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.635 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.487 ' C ' ' O ' ' A' ' 40' ' ' ASP . 69.7 mm-40 15.42 -90.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.687 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 mtpt -99.68 63.8 1.25 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.734 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 40.41 50.18 2.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.374 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.28 121.25 42.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.553 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.77 86.65 7.35 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -99.36 144.36 28.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.226 -178.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.672 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -63.02 101.42 0.27 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.322 179.601 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mt -92.59 120.79 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.108 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.4 m -92.47 116.3 28.87 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.26 139.65 30.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.245 0.545 . . . . 0.0 111.281 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -109.42 -22.47 12.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.296 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.318 . . . . 0.0 111.27 -179.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.456 -0.172 0 CA-C-O 120.697 0.284 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.911 0.386 . . . . 0.0 111.513 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.55 ' C ' HG12 ' A' ' 7' ' ' VAL . 38.8 mttt -144.99 -164.46 1.93 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.301 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.55 HG12 ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -167.69 157.16 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.432 . . . . 0.0 110.971 -179.42 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.604 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.86 107.78 17.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.991 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.49 4.88 0.33 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.604 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 4.9 p30 172.96 123.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.987 0.423 . . . . 0.0 110.701 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.558 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER 178.66 156.79 0.6 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.439 -179.843 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.404 ' C ' ' O ' ' A' ' 11' ' ' TYR . 41.5 Cg_exo -30.11 84.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 123.31 2.674 . . . . 0.0 112.939 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.558 ' N ' ' O ' ' A' ' 11' ' ' TYR . 8.8 t -57.2 -36.74 52.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.546 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.33 -49.96 73.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.028 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -64.48 99.13 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.964 0.411 . . . . 0.0 110.388 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -172.08 110.64 0.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.286 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.495 ' O ' ' O ' ' A' ' 18' ' ' LEU . 75.7 mt-30 -137.36 52.85 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.651 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 20.8 mt 32.87 97.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.98 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 99.99 146.48 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 O-C-N 123.679 0.612 . . . . 0.0 111.422 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 22' ' ' CYS . 11.8 t-20 63.66 -79.3 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.671 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.53 39.99 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.586 ' N ' ' O ' ' A' ' 20' ' ' ASN . 9.9 t -179.58 -52.82 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.457 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.441 ' OD1' ' C ' ' A' ' 23' ' ' ASN . 10.8 t-20 -58.26 -54.24 49.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.146 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.523 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -57.39 -44.36 84.43 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.71 178.868 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 29' ' ' ASP . 0.1 OUTLIER -54.3 -58.64 6.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.521 179.729 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.55 ' C ' ' H ' ' A' ' 28' ' ' LEU . 85.1 m -55.11 -42.1 72.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -62.28 12.26 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.697 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.55 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.2 tp -162.86 -44.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.631 -179.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.641 ' N ' ' O ' ' A' ' 25' ' ' ASP . 94.1 m-20 -68.34 -17.41 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.056 0.455 . . . . 0.0 110.496 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.429 ' NZ ' ' O ' ' A' ' 7' ' ' VAL . 41.8 mttt -140.24 3.63 1.97 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.05 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.4 m170 53.23 35.9 21.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.965 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.657 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.46 -167.76 1.99 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -97.17 -44.75 6.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.023 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 84.0 p -157.69 -155.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.099 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 158.23 -171.53 35.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.448 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -175.98 162.61 2.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.933 0.397 . . . . 0.0 111.123 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 73.3 m -88.81 138.1 31.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.092 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -148.74 146.82 28.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.922 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.404 ' CE1' ' HG ' ' A' ' 45' ' ' LEU . 64.9 m-85 -86.36 160.64 19.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.6 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -93.33 -172.92 3.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.618 179.587 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -65.49 19.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.54 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.6 ' H ' ' C ' ' A' ' 40' ' ' ASP . 13.4 mtpp -140.93 -73.41 0.34 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.092 179.613 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.453 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 9.8 mtp85 153.45 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.644 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.47 ' O ' ' O ' ' A' ' 45' ' ' LEU . 0.7 OUTLIER -109.48 -0.25 18.95 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -178.979 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.47 ' O ' ' O ' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 57.3 136.77 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.752 0.311 . . . . 0.0 111.074 179.791 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -147.78 170.62 17.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.837 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.12 108.99 13.98 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.095 0.474 . . . . 0.0 111.515 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.9 mt -87.06 129.25 38.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.51 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.5 m -110.11 118.73 37.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.853 0.358 . . . . 0.0 111.187 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.657 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 4.8 t0 -96.55 152.95 18.15 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.794 179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 32' ' ' ALA . 13.8 m-85 -130.23 3.62 4.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.958 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 40.9 m . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.423 -179.954 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-O 120.78 0.324 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.457 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -141.11 113.99 8.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.435 179.828 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -98.54 125.36 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.189 -179.098 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.435 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -66.98 146.25 13.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.626 178.801 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.57 84.22 6.81 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.096 0.474 . . . . 0.0 109.8 179.246 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.585 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -67.08 113.91 5.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.687 179.839 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.585 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 23.3 t-20 117.17 -34.25 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 O-C-N 124.144 0.902 . . . . 0.0 110.698 179.835 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.577 ' O ' ' O ' ' A' ' 12' ' ' PRO . 38.2 t80 -41.25 140.32 1.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.241 -179.995 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.577 ' O ' ' O ' ' A' ' 11' ' ' TYR . 72.6 Cg_exo -48.22 -146.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.413 2.075 . . . . 0.0 113.408 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.56 HG22 ' C ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -169.99 74.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.449 -179.984 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.9 p -174.17 -64.93 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -67.72 97.28 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.256 179.103 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 0.8 OUTLIER -170.97 113.0 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.44 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mm-40 156.72 -48.85 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.897 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' C ' ' A' ' 19' ' ' ALA . 10.9 mt -71.16 52.86 0.17 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.004 -179.542 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.544 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 3.78 84.97 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.974 0.797 . . . . 0.0 112.26 179.313 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.485 ' O ' ' C ' ' A' ' 21' ' ' GLN . 36.7 t30 -164.18 -96.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.283 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.485 ' C ' ' O ' ' A' ' 20' ' ' ASN . 13.1 mm100 -28.88 -76.8 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.489 -179.514 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.2 t -48.12 -64.95 0.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.904 0.383 . . . . 0.0 111.616 -179.735 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.504 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 2.8 t30 -47.63 -70.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.681 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -50.61 -43.32 56.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.3 m-20 -51.77 -65.59 0.53 Allowed 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.509 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.41 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.5 m -52.8 -42.08 64.74 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.068 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.9 tttp -59.14 1.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.747 -179.698 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.41 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.0 tt -167.81 -44.8 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.732 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 14.3 m-20 -64.62 -2.19 2.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.944 0.402 . . . . 0.0 110.78 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.7 mttm -144.75 8.58 1.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.33 179.338 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 53.48 36.03 22.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.768 179.978 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.593 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -88.11 -178.21 5.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 111.451 -179.691 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.485 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -93.68 -31.32 14.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.465 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.1 p -176.72 -160.9 0.07 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.776 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.504 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 146.68 173.41 17.89 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.249 -0.977 . . . . 0.0 112.775 179.615 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.408 ' HG3' ' H ' ' A' ' 37' ' ' CYS . 0.4 OUTLIER -176.49 179.01 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.844 0.354 . . . . 0.0 110.652 179.964 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.408 ' H ' ' HG3' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -87.44 103.29 15.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.531 179.712 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -95.22 152.49 18.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.417 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.635 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 20.0 m-85 -96.5 -166.8 1.47 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.287 179.269 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.591 ' C ' ' H ' ' A' ' 42' ' ' LYS . 14.1 p-10 -133.68 -174.06 3.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.815 0.34 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.69 28.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.858 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -145.6 -81.76 0.15 Allowed 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.268 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.08 39.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.441 179.142 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.635 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 27.1 m-20 -90.17 -168.1 2.03 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.143 -179.315 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.49 HD21 ' CE1' ' A' ' 39' ' ' TYR . 7.7 mt -152.3 133.64 14.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 111.619 -179.552 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -148.51 137.81 21.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.114 179.065 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.09 96.2 6.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.96 0.41 . . . . 0.0 111.217 -179.351 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.72 114.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.713 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -93.14 115.06 27.72 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.935 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.593 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 7.4 t70 -87.92 142.94 27.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.969 0.414 . . . . 0.0 111.584 -178.932 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -118.01 -27.26 6.18 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.485 -179.663 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.276 -179.358 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 120.738 0.304 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm -138.0 129.08 27.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -148.89 126.47 11.68 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.815 0.341 . . . . 0.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -63.22 158.28 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.338 179.055 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.463 ' O ' ' C ' ' A' ' 9' ' ' GLU . 23.5 t80 -82.64 -15.75 50.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.055 0.455 . . . . 0.0 111.433 -179.368 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.463 ' C ' ' O ' ' A' ' 8' ' ' TYR . 1.9 pt-20 26.57 78.8 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.724 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.417 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 3.7 m-20 165.1 -41.23 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.204 179.513 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -52.16 108.86 1.18 Allowed Pre-proline 0 CA--C 1.535 0.401 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.593 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.615 ' O ' ' N ' ' A' ' 14' ' ' SER . 94.2 Cg_endo -81.57 70.41 7.32 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.179 1.919 . . . . 0.0 112.299 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.577 HG13 HD23 ' A' ' 45' ' ' LEU . 2.6 t 18.85 44.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 123.85 0.719 . . . . 0.0 112.142 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.615 ' N ' ' O ' ' A' ' 12' ' ' PRO . 3.7 p -67.42 -7.58 26.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.512 -179.929 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.494 ' O ' ' C ' ' A' ' 16' ' ' CYS . 30.0 tptt -172.35 -88.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.381 -179.712 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.5 OUTLIER 26.37 97.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.397 -179.787 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -144.17 1.76 1.11 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.157 -179.933 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.456 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 10.7 mt -164.24 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.297 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 176.58 109.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.794 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -179.13 -82.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.336 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.452 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 3.3 tp60 -46.45 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.224 -179.414 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.28 -40.18 85.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.523 -179.57 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -53.23 -65.94 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.41 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.563 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -52.24 -42.2 63.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.033 178.882 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.9 m-20 -50.79 -60.73 2.75 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.815 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 28' ' ' LEU . 57.0 m -54.86 -49.9 70.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 178.379 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 17.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.869 179.503 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.517 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.5 tm? -165.47 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.018 -0.673 . . . . 0.0 112.262 -179.395 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.643 ' N ' ' O ' ' A' ' 25' ' ' ASP . 11.0 m-20 -67.77 -11.73 59.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.743 0.306 . . . . 0.0 111.16 -179.507 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 31' ' ' HIS . 24.9 mttm -139.14 27.21 2.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.849 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 34.71 38.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.287 0.565 . . . . 0.0 110.328 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.571 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -83.7 176.75 8.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.814 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.437 ' H ' ' HA ' ' A' ' 51' ' ' TYR . 31.3 ttm180 -92.81 -27.62 17.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 -179.967 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.8 p 177.96 -165.08 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.497 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.77 -176.88 47.58 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.476 -179.982 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -175.49 157.57 2.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.882 0.372 . . . . 0.0 110.962 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -90.7 104.38 16.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.603 -179.556 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -96.19 171.54 8.54 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.53 ' O ' ' O ' ' A' ' 40' ' ' ASP . 3.5 m-85 -99.11 -8.84 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.626 0.251 . . . . 0.0 111.039 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.53 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.4 OUTLIER 50.43 161.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.0 111.276 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -63.98 8.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.094 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -105.35 -23.72 12.8 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-O 120.9 0.381 . . . . 0.0 110.578 -179.982 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 66.29 52.2 1.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.665 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -139.24 12.22 2.59 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.825 0.345 . . . . 0.0 111.492 -179.641 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.577 HD23 HG13 ' A' ' 13' ' ' VAL . 4.7 tp 64.79 122.36 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.191 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -143.19 155.05 44.45 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.832 179.228 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 98.7 m -98.47 113.13 25.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.981 0.42 . . . . 0.0 112.016 -179.136 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -91.8 117.01 34.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.569 179.607 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.9 m -94.95 112.15 23.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.959 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.571 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 3.6 t70 -94.85 154.21 17.35 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.971 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.437 ' HA ' ' H ' ' A' ' 33' ' ' ARG . 66.7 m-85 -131.04 -22.34 2.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.438 -179.017 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.214 0 CA-C-O 120.724 0.297 . . . . 0.0 110.948 -179.439 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.054 0.455 . . . . 0.0 110.671 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -97.23 121.45 39.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.889 179.859 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.73 126.1 24.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.064 0.459 . . . . 0.0 111.144 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.5 m -62.36 149.52 9.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.014 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' O ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -51.01 -103.44 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.7 179.19 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.454 ' H ' ' HB3' ' A' ' 8' ' ' TYR . 0.7 OUTLIER 178.13 -14.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.378 -0.201 . . . . 0.0 111.484 179.445 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -178.01 21.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.326 . . . . 0.0 110.996 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.491 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 49.8 t80 -56.01 113.54 5.96 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.02 99.23 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.077 1.851 . . . . 0.0 112.256 179.926 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -53.7 92.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.39 179.759 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.556 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 0.6 OUTLIER -175.46 128.5 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.797 -179.702 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 14' ' ' SER . 2.9 tptt 92.62 -13.35 0.17 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.631 -179.82 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m -66.56 70.61 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.728 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' A' ' 15' ' ' LYS . 10.3 mp0 -114.43 -15.62 12.05 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.376 -179.734 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.587 ' N ' HD12 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -162.11 176.27 10.87 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.93 0.395 . . . . 0.0 110.349 -179.843 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -56.7 -149.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.639 -179.837 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 61.55 -79.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.262 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.491 ' OE1' ' OH ' ' A' ' 11' ' ' TYR . 7.8 tp-100 -41.18 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.153 -179.645 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 t -59.36 -41.89 90.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.22 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.21 -74.16 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.009 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.539 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -49.33 -40.12 34.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.529 179.92 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 7.7 m-20 -55.64 -65.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.137 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.456 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.9 m -56.33 -35.93 68.17 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.906 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttpp -59.86 2.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.93 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.456 ' H ' ' C ' ' A' ' 26' ' ' CYS . 13.2 tp -165.14 -36.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.0 m-20 -67.86 -14.17 62.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -141.38 16.9 2.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.756 179.677 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.4 m80 53.2 29.11 7.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.62 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.46 -175.61 5.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.634 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -98.41 -50.34 4.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 -179.82 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.0 OUTLIER -141.43 -173.58 3.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.323 179.595 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.457 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . -168.21 166.38 39.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.063 -1.065 . . . . 0.0 113.363 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -177.2 146.68 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.05 138.43 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.993 0.425 . . . . 0.0 111.527 -179.453 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.19 158.1 43.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.644 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.563 ' CE2' ' CD2' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -81.93 155.26 25.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.839 179.77 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.55 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 4.6 p-10 -161.5 58.62 0.28 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.832 0.348 . . . . 0.0 111.688 -179.885 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 19.1 tp10 93.34 -16.86 0.12 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.47 -0.787 . . . . 0.0 111.579 178.685 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.61 -7.53 34.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.234 -179.221 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? 40.11 39.87 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.236 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -143.64 5.58 1.4 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.563 ' CD2' ' CE2' ' A' ' 39' ' ' TYR . 1.0 OUTLIER 71.65 152.67 0.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.192 179.441 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -149.09 137.4 20.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.163 179.483 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 98.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 43.0 mm -89.82 113.29 25.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.2 m -92.36 129.84 38.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.079 0.466 . . . . 0.0 111.231 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -96.13 125.17 40.47 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.689 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -98.92 -27.44 13.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.752 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.8 m . . . . . 0 C--N 1.331 -0.217 0 CA-C-O 121.184 0.516 . . . . 0.0 110.867 179.741 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.53 0.205 0 CA-C-O 120.399 0.142 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -87.7 143.29 27.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.312 0.577 . . . . 0.0 112.037 -178.782 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -147.88 122.16 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.922 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.74 149.89 5.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.398 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.477 ' N ' ' O ' ' A' ' 47' ' ' CYS . 0.3 OUTLIER -105.86 76.65 1.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.875 -1.057 . . . . 0.0 108.305 177.719 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 11' ' ' TYR . 1.6 pt-20 -47.63 -94.0 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.689 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -47.18 92.76 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.377 178.877 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.496 ' N ' ' O ' ' A' ' 9' ' ' GLU . 67.1 t80 -177.8 107.29 0.22 Allowed Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.05 -179.099 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.589 ' O ' ' N ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.57 124.36 8.05 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.351 2.034 . . . . 0.0 112.276 179.925 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.662 ' O ' HG12 ' A' ' 13' ' ' VAL . 40.8 t -60.57 45.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.938 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.589 ' N ' ' O ' ' A' ' 12' ' ' PRO . 78.5 p -63.3 -125.86 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.476 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -68.64 151.91 46.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.335 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.464 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -173.27 -32.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.205 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -74.19 38.93 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.608 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 16' ' ' CYS . 27.4 mt -161.91 -102.58 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.828 -179.639 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -179.62 -153.69 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.415 -179.443 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.74 -82.49 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.417 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.457 ' C ' ' O ' ' A' ' 20' ' ' ASN . 2.9 tp60 -33.82 -76.46 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.475 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.91 -52.34 65.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.244 0.545 . . . . 0.0 110.661 179.242 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -78.25 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.32 -179.623 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -44.87 -48.98 11.15 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.832 -179.361 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.451 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 5.0 m-20 -52.88 -65.77 0.5 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.442 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.475 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -57.34 -29.9 64.37 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.52 -179.854 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.84 1.54 0.14 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.071 179.131 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.475 ' H ' ' C ' ' A' ' 26' ' ' CYS . 23.6 tp -162.44 -31.73 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.391 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -68.63 -17.56 64.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.202 0.525 . . . . 0.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -141.93 -1.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.54 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.3 m80 63.73 42.15 6.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.791 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.496 ' HB2' ' CE2' ' A' ' 51' ' ' TYR . . . -89.03 -173.62 4.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 8.1 ttp180 -98.99 -56.5 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.999 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 48.4 p -167.55 135.34 2.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.038 -179.931 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -123.28 -165.13 12.25 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.42 -0.895 . . . . 0.0 114.983 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -176.14 -145.77 0.02 OUTLIER 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.16 -1.02 . . . . 0.0 109.118 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.17 137.55 20.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.655 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.537 ' CD2' ' CD1' ' A' ' 48' ' ' ILE . 19.6 m-85 -142.21 157.07 45.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.304 178.968 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.532 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 17.2 m-85 -72.08 169.3 16.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.433 -179.582 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -162.9 -158.94 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.436 -179.488 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -62.88 -11.26 17.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.828 -179.36 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.591 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -94.62 10.15 35.96 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.084 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 52.33 2.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.983 0.421 . . . . 0.0 111.144 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.804 ' C ' HD23 ' A' ' 45' ' ' LEU . 49.4 m-20 -100.88 -136.04 0.31 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.619 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.804 HD23 ' C ' ' A' ' 44' ' ' ASN . 0.2 OUTLIER -152.39 118.47 5.5 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.317 0.579 . . . . 0.0 111.183 179.053 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -97.26 152.03 19.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.548 -179.601 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -78.18 113.38 16.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.665 179.617 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.537 ' CD1' ' CD2' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -101.31 113.0 36.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.739 -179.693 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.3 m -99.11 134.56 41.78 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.338 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.2 t70 -95.2 115.81 27.92 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.849 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.496 ' CE2' ' HB2' ' A' ' 32' ' ' ALA . 96.8 m-85 -103.43 57.0 0.74 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.648 -179.224 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.158 -179.531 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 121.134 0.492 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.05 155.99 43.16 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.791 179.275 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -151.01 110.24 3.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.017 0.437 . . . . 0.0 111.198 -179.698 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.411 HG13 ' H ' ' A' ' 7' ' ' VAL . 1.6 m -66.45 144.84 14.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.239 179.876 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.553 ' O ' ' CG ' ' A' ' 9' ' ' GLU . 1.9 t80 -63.13 -75.52 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.484 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.58 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.3 pp20? 104.26 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 O-C-N 124.649 1.218 . . . . 0.0 112.074 178.466 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.58 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 10.4 t-20 107.89 -12.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.346 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -52.92 113.49 4.65 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.847 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -42.73 112.48 0.27 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.014 1.81 . . . . 0.0 112.101 179.812 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.507 ' O ' ' C ' ' A' ' 14' ' ' SER . 69.4 t -52.7 -70.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.507 ' C ' ' O ' ' A' ' 13' ' ' VAL . 20.6 p 21.28 -95.04 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.669 179.974 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -69.82 108.95 4.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.477 179.667 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.27 57.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -141.54 22.46 2.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.82 179.943 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -167.81 125.87 1.21 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.53 179.947 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.24 99.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.627 -179.785 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -175.98 -68.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.603 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -47.99 -74.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.873 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.8 t -58.52 -40.52 83.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.181 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -53.49 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 -179.674 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.554 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.37 -45.39 62.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.344 179.998 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -64.48 0.8 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.835 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.446 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.2 m -54.45 -33.61 59.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -61.89 3.37 0.16 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.591 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.446 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.9 OUTLIER -164.35 -27.26 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.531 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -70.02 -29.67 66.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.789 0.328 . . . . 0.0 110.993 -179.899 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 31' ' ' HIS . 1.8 mtmp? -141.66 40.88 1.71 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.957 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.448 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.4 m80 31.73 44.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.363 179.864 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.12 179.27 6.17 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.92 0.39 . . . . 0.0 111.244 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.416 HH11 ' HG3' ' A' ' 33' ' ' ARG . 34.9 ttm-85 -96.15 -20.31 18.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.984 179.406 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.0 p 177.84 -176.24 0.18 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.241 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.6 167.87 36.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.796 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -177.24 157.21 1.32 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.805 0.336 . . . . 0.0 110.44 179.766 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -89.53 106.16 18.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.43 -179.369 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.454 ' HB2' HD12 ' A' ' 48' ' ' ILE . 30.0 m-85 -107.96 151.28 26.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.897 179.811 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.401 ' CE2' HD22 ' A' ' 45' ' ' LEU . 8.1 m-85 -81.13 177.17 9.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.935 0.398 . . . . 0.0 111.592 -179.76 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 42' ' ' LYS . 1.4 p30 -167.94 95.24 0.42 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.01 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' A' ' 40' ' ' ASP . 14.4 tt0 27.02 32.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.263 -179.908 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.641 ' N ' ' O ' ' A' ' 40' ' ' ASP . 16.9 mtpp -147.19 0.76 0.72 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.24 179.815 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 61.89 0.98 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.022 0.439 . . . . 0.0 110.283 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.59 ' ND2' ' O ' ' A' ' 42' ' ' LYS . 1.9 m120 -92.94 133.35 36.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.152 179.456 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.421 ' HG ' ' H ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -86.44 117.49 25.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.569 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -100.63 141.45 33.48 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.086 178.653 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.88 94.26 1.41 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.96 0.409 . . . . 0.0 111.42 -179.682 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.454 HD12 ' HB2' ' A' ' 38' ' ' PHE . 5.8 mt -90.13 120.32 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.562 179.58 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.4 m -92.75 114.97 27.68 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 178.927 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.69 135.49 33.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.978 0.418 . . . . 0.0 111.246 -179.254 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.408 ' OH ' ' O ' ' A' ' 30' ' ' LYS . 10.7 m-85 -109.66 -21.84 12.23 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.047 -178.891 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.4 m . . . . . 0 C--N 1.332 -0.177 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.828 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.248 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -96.48 132.86 41.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.16 0.505 . . . . 0.0 111.906 -179.227 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -146.83 134.79 21.41 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.76 179.908 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.478 ' O ' ' OE2' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -65.2 154.75 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.441 -179.919 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.475 ' OH ' ' OD2' ' A' ' 29' ' ' ASP . 1.0 OUTLIER -92.68 85.06 5.13 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.397 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.544 ' O ' ' C ' ' A' ' 10' ' ' ASN . 1.0 OUTLIER -58.1 171.6 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 -178.917 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.544 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 16.02 101.09 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.599 0.562 . . . . 0.0 111.568 -179.389 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.5 OUTLIER 175.91 141.13 0.21 Allowed Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.037 -178.92 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -34.03 80.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.948 2.432 . . . . 0.0 113.07 -179.604 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.62 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.8 p -60.23 -27.06 38.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.448 179.841 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.42 -45.93 90.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.329 -179.39 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.42 82.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.04 0.448 . . . . 0.0 110.614 -179.782 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -173.64 95.08 0.1 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 179.867 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -120.43 -34.15 3.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.933 179.552 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.458 HD23 ' HA ' ' A' ' 18' ' ' LEU . 7.0 mt -164.69 -175.21 3.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.304 179.852 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.559 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -53.82 177.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.376 -179.963 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 19' ' ' ALA . 7.9 t-20 96.93 -85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.778 179.697 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -50.82 -70.04 0.1 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.699 0.285 . . . . 0.0 111.66 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.558 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.3 t -53.93 -45.15 71.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.17 -179.481 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -55.47 -66.9 0.34 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.061 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.55 -47.44 57.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.817 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.454 ' O ' ' C ' ' A' ' 28' ' ' LEU . 2.2 m-20 -52.67 -51.11 61.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.555 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.643 ' C ' ' H ' ' A' ' 28' ' ' LEU . 87.4 m -57.88 -40.79 81.07 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.585 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -57.46 -0.45 0.06 Allowed 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 177.574 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.711 ' O ' ' N ' ' A' ' 30' ' ' LYS . 10.1 tp -162.96 -139.39 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.202 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.475 ' OD2' ' OH ' ' A' ' 8' ' ' TYR . 3.7 m-20 65.24 -50.39 0.36 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 -177.16 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.711 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -126.06 -85.97 0.62 Allowed 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.389 175.772 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.519 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.9 OUTLIER 169.13 54.16 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.41 178.053 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.05 179.73 6.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.799 179.468 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.28 -33.46 12.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.184 0.516 . . . . 0.0 110.482 -179.991 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.6 p -166.42 -162.57 0.53 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.569 -0.742 . . . . 0.0 109.811 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 177.72 -168.58 40.16 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 119.693 -1.242 . . . . 0.0 113.471 179.847 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.558 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.7 OUTLIER -177.06 -158.54 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -179.921 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.32 144.79 26.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 111.508 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.449 ' O ' ' N ' ' A' ' 46' ' ' GLN . 57.5 m-85 -144.77 159.97 42.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.198 -179.705 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.596 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 3.1 m-85 -84.44 173.97 10.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.683 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -153.85 -171.4 3.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.929 0.395 . . . . 0.0 111.133 -179.769 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -12.93 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.533 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' ' C ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -95.04 25.88 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.887 -179.912 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 29.55 55.2 0.13 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.192 179.566 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 75.6 m-20 -141.8 -125.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.704 179.701 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.543 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -148.78 162.43 39.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.318 . . . . 0.0 110.592 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 38' ' ' PHE . 83.5 mt-30 -148.3 114.57 5.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.704 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -68.52 102.95 1.56 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.453 -179.513 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.6 mm -89.09 114.89 27.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.06 179.304 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.8 m -98.0 119.21 36.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.988 0.423 . . . . 0.0 110.894 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.13 130.02 44.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.176 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -95.56 -21.67 18.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.963 -179.613 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.6 m . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.947 -179.752 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.534 0.343 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.34 148.73 40.17 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.915 0.388 . . . . 0.0 110.355 179.71 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -150.36 125.56 10.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.881 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -65.58 150.13 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-O 120.837 0.351 . . . . 0.0 111.063 179.768 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.503 ' O ' ' O ' ' A' ' 9' ' ' GLU . 30.2 t80 -100.19 -10.92 20.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.214 0.531 . . . . 0.0 110.888 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.563 ' O ' ' C ' ' A' ' 10' ' ' ASN . 2.0 pm0 34.31 -158.04 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.64 -179.576 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.563 ' C ' ' O ' ' A' ' 9' ' ' GLU . 37.2 t-20 2.42 102.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.671 0.607 . . . . 0.0 111.863 -179.719 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.3 OUTLIER 179.97 141.13 0.32 Allowed Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.561 -179.197 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -40.03 90.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.232 1.955 . . . . 0.0 112.409 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.639 ' O ' ' N ' ' A' ' 15' ' ' LYS . 54.7 t -52.87 -90.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.361 179.863 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.496 ' C ' ' O ' ' A' ' 13' ' ' VAL . 60.7 p 9.96 -70.21 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.864 0.728 . . . . 0.0 112.866 179.206 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -60.28 89.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.997 -179.546 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 116.92 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.356 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -114.15 -54.16 2.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.569 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.447 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 1.4 mt -174.2 -20.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.918 179.467 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.447 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 178.7 104.24 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.631 -179.693 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -175.64 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.163 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.439 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 30.7 mm100 -50.71 -52.05 43.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.802 -179.772 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.65 -59.29 5.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 179.987 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -49.8 -63.68 1.04 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.57 -179.833 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -48.7 69.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.312 179.564 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 29' ' ' ASP . 23.7 m-20 -49.24 -65.14 0.62 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.5 179.816 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 28' ' ' LEU . 62.7 m -49.93 -41.99 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.326 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -61.0 10.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.659 179.169 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 26' ' ' CYS . 11.3 tp -163.14 -30.1 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.684 0.278 . . . . 0.0 111.711 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -70.0 -61.35 1.81 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.345 179.776 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.84 19.17 14.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 53.2 32.94 14.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 -179.31 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.601 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -84.28 -177.35 6.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.784 -179.431 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.0 -42.06 8.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.767 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.3 p -154.85 -156.44 0.67 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.842 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 171.2 -175.91 44.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.569 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -177.78 155.82 1.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.998 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.459 ' SG ' ' O ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -87.43 155.48 20.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.876 0.369 . . . . 0.0 110.899 179.99 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -146.65 121.13 9.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.808 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.662 ' CE1' HD21 ' A' ' 45' ' ' LEU . 34.8 m-85 -70.87 -93.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.245 179.555 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.54 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER 53.94 147.65 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.499 0.666 . . . . 0.0 111.694 179.409 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.54 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 2.6 tt0 89.62 -79.22 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.728 178.299 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.63 73.65 1.19 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.201 -178.792 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.58 38.78 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.296 179.314 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.634 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 17.5 m120 -92.77 -163.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.132 179.76 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.662 HD21 ' CE1' ' A' ' 39' ' ' TYR . 9.2 mt -155.23 98.22 1.98 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.786 0.327 . . . . 0.0 111.266 179.984 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.459 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 78.1 mt-30 -94.79 170.51 9.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.018 179.148 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.8 109.46 15.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.042 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mm -92.68 121.62 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.55 179.367 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.93 122.58 43.07 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.647 0.26 . . . . 0.0 110.63 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.601 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.1 OUTLIER -93.85 141.63 28.29 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.91 0.386 . . . . 0.0 110.63 -179.996 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -114.75 -12.83 12.1 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.907 -179.102 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.242 0 CA-C-O 120.624 0.25 . . . . 0.0 111.374 -179.388 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.138 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -95.42 135.92 36.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 113.83 7.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.998 0.427 . . . . 0.0 111.331 -179.434 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.445 HG13 ' H ' ' A' ' 7' ' ' VAL . 0.8 OUTLIER -65.3 135.93 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.458 179.228 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.531 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -64.82 106.61 1.25 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.902 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 10' ' ' ASN . 8.5 mt-10 -63.06 43.16 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.324 -178.785 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 8' ' ' TYR . 14.4 m-20 172.42 -97.75 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.561 179.878 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.519 ' C ' ' O ' ' A' ' 10' ' ' ASN . 8.2 t80 8.52 76.37 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.423 0 O-C-N 123.733 0.645 . . . . 0.0 112.63 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.542 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.6 Cg_exo -62.66 109.66 0.94 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.985 2.457 . . . . 0.0 112.026 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.555 ' O ' ' CB ' ' A' ' 14' ' ' SER . 21.6 t 8.75 -108.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 O-C-N 123.845 0.716 . . . . 0.0 112.039 179.946 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 13' ' ' VAL . 5.1 p 91.33 -45.15 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.754 0.312 . . . . 0.0 111.457 179.124 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -172.56 74.94 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.977 0.418 . . . . 0.0 110.874 -178.972 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -66.44 -59.9 3.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.893 -179.689 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.596 ' O ' ' N ' ' A' ' 19' ' ' ALA . 0.9 OUTLIER 61.5 10.81 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.738 179.207 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.482 HD12 ' N ' ' A' ' 18' ' ' LEU . 6.5 mp 30.79 30.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' A' ' 17' ' ' GLN . . . 175.99 35.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.732 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 22' ' ' CYS . 8.6 t-20 -166.47 -141.29 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.518 179.537 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.548 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.6 OUTLIER 2.62 -69.37 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 124.008 0.817 . . . . 0.0 111.981 179.721 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.586 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.1 t -58.94 -65.71 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.023 179.57 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' ASN . 44.4 t-20 -51.29 -54.81 22.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.958 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -54.33 -44.63 72.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.137 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 78.6 m-20 -57.28 -64.79 0.77 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.219 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.479 ' C ' ' H ' ' A' ' 28' ' ' LEU . 58.1 m -52.78 -51.46 60.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.742 179.846 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -59.72 10.55 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.816 -179.799 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.479 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.82 -52.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 119.998 -0.681 . . . . 0.0 112.72 -179.495 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.5 OUTLIER -66.72 -7.57 21.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.578 0.228 . . . . 0.0 111.474 -179.12 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.409 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -141.81 24.84 2.01 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.952 0.406 . . . . 0.0 110.378 179.448 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.7 m80 38.46 38.91 0.27 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.037 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.16 -176.35 5.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.827 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -95.85 -45.27 7.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.384 179.825 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.474 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 2.7 p -168.93 130.96 1.24 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.92 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -101.98 174.88 24.71 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.33 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -174.92 138.31 0.46 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.982 0.42 . . . . 0.0 110.583 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.2 m -89.48 113.12 24.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.416 -179.453 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.623 ' CD1' HD12 ' A' ' 48' ' ' ILE . 18.7 m-85 -97.98 141.54 30.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.423 179.297 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.494 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 9.5 m-85 -83.26 -169.67 2.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.936 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.562 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 2.9 p-10 -173.59 156.03 2.87 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.346 0.593 . . . . 0.0 112.04 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.464 ' C ' ' O ' ' A' ' 40' ' ' ASP . 21.9 mt-10 16.92 -82.27 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.103 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.9 mptt -91.64 60.87 4.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.232 0.539 . . . . 0.0 110.943 -178.917 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.467 ' C ' ' O ' ' A' ' 42' ' ' LYS . 28.3 mmt180 29.04 60.44 0.14 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.584 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.689 ' C ' HD12 ' A' ' 45' ' ' LEU . 0.6 OUTLIER -95.39 -154.53 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.792 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.689 HD12 ' C ' ' A' ' 44' ' ' ASN . 5.7 mp -155.23 140.73 17.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.844 0.354 . . . . 0.0 110.995 179.545 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -143.05 131.81 22.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.252 179.834 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.66 101.73 4.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.358 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.623 HD12 ' CD1' ' A' ' 38' ' ' PHE . 15.7 mt -95.84 114.31 32.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.474 178.194 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.409 ' SG ' ' NZ ' ' A' ' 30' ' ' LYS . 91.7 m -94.73 118.8 32.32 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.301 179.364 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.1 t0 -94.45 118.3 31.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.452 0.644 . . . . 0.0 111.212 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -99.21 -89.65 0.31 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.029 179.6 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.4 m . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.032 179.53 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.806 0.336 . . . . 0.0 110.752 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.92 97.01 3.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.411 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.4 mttt -93.72 107.22 19.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.897 0.38 . . . . 0.0 111.36 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.42 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.1 m -66.55 130.7 32.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.719 179.873 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.546 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -74.27 58.58 0.73 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.069 0.461 . . . . 0.0 110.442 179.504 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.567 ' O ' ' N ' ' A' ' 11' ' ' TYR . 7.1 mt-10 26.2 -153.61 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.442 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -60.16 56.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.611 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.567 ' N ' ' O ' ' A' ' 9' ' ' GLU . 42.8 t80 -50.69 140.97 18.41 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.414 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.409 ' HD2' ' CG ' ' A' ' 11' ' ' TYR . 17.0 Cg_endo -57.29 92.48 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 -179.68 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.0 t -53.88 105.88 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.185 -179.622 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 p -176.33 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.05 179.98 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.571 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 16.2 mmmt -66.02 136.39 55.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.108 179.169 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.571 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.5 m -170.11 -64.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.616 0.246 . . . . 0.0 111.492 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.477 ' C ' ' O ' ' A' ' 16' ' ' CYS . 1.7 mm-40 -28.14 -38.8 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.408 -179.478 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 16' ' ' CYS . 1.1 mp -70.65 -120.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.19 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.45 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -179.65 -20.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.248 0.547 . . . . 0.0 111.631 -179.736 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.479 ' O ' ' C ' ' A' ' 21' ' ' GLN . 35.6 t30 -47.62 -106.38 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.847 -178.93 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.479 ' C ' ' O ' ' A' ' 20' ' ' ASN . 11.2 mm100 -25.26 -60.22 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.309 -179.131 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -54.04 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.937 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 2.5 t-20 -48.73 -54.83 13.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.901 -179.324 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -52.29 -55.83 18.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.648 179.907 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 96.8 m-20 -50.74 -55.16 17.99 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.262 -179.619 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.0 m -54.85 -45.9 74.61 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.938 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -61.44 11.84 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.531 -0.758 . . . . 0.0 112.223 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.7 tt -165.02 -47.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.294 -0.562 . . . . 0.0 112.261 -179.469 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 92.4 m-20 -66.7 -11.27 53.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.133 0.492 . . . . 0.0 110.169 179.789 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.427 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 36.0 mmtm -141.72 5.37 1.77 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.038 179.427 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.427 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 41.17 46.05 2.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.737 -179.866 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.32 -173.7 4.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.917 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.12 -23.59 18.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.291 0.567 . . . . 0.0 109.698 179.541 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -177.64 -168.44 0.18 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.993 179.702 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.468 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . 166.95 170.26 31.6 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.929 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -179.31 -179.97 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.732 0.301 . . . . 0.0 110.259 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 39.1 m -88.61 88.82 7.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.266 179.391 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.524 ' HB2' HD12 ' A' ' 48' ' ' ILE . 42.9 m-85 -91.72 159.06 16.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.834 -179.734 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.565 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 5.0 m-85 -83.77 166.26 18.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.008 179.926 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.538 ' CG ' HE22 ' A' ' 46' ' ' GLN . 6.3 p-10 -129.19 -173.15 2.91 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.047 -179.532 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.52 2.06 0.19 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.29 -179.656 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -95.61 -63.89 1.11 Allowed 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.391 179.777 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.557 ' HB2' ' O ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 139.78 5.08 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.225 1.41 . . . . 0.0 109.734 179.397 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.917 ' O ' HD23 ' A' ' 45' ' ' LEU . 0.4 OUTLIER -90.96 -140.63 0.16 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.882 0.372 . . . . 0.0 111.302 -179.518 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.917 HD23 ' O ' ' A' ' 44' ' ' ASN . 0.2 OUTLIER -147.32 149.16 32.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 -179.597 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.538 HE22 ' CG ' ' A' ' 40' ' ' ASP . 3.5 mp0 -148.83 136.78 20.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.674 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.424 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -66.18 87.19 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.768 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.524 HD12 ' HB2' ' A' ' 38' ' ' PHE . 9.7 mt -86.57 124.07 40.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.047 0.451 . . . . 0.0 111.627 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.7 m -93.12 110.68 22.18 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.202 178.442 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.62 130.5 37.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.37 0.605 . . . . 0.0 112.084 -178.509 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -100.01 -42.04 6.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.24 179.366 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.169 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.296 -179.473 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.44 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.8 m . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 120.866 0.365 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 138.32 24.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.743 0.306 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -143.76 114.65 7.76 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.539 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.44 ' O ' HG23 ' A' ' 7' ' ' VAL . 2.7 m -66.53 127.82 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.047 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -85.19 80.09 9.33 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.312 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -57.29 -70.38 0.13 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.398 0.618 . . . . 0.0 110.042 -179.003 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 60.0 t-20 -51.92 86.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.707 178.964 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.618 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.7 t80 -177.8 97.34 0.22 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.452 -179.027 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.537 ' O ' ' C ' ' A' ' 13' ' ' VAL . 79.8 Cg_exo -45.94 75.65 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.814 2.342 . . . . 0.0 112.978 -179.574 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.618 ' N ' ' O ' ' A' ' 11' ' ' TYR . 15.9 t -7.86 -62.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 O-C-N 123.798 0.686 . . . . 0.0 112.52 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.565 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 67.4 p 27.23 -92.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.481 -179.82 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.565 ' N ' ' OG ' ' A' ' 14' ' ' SER . 0.1 OUTLIER -68.9 156.49 38.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.54 -179.624 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 1.7 m -172.59 -37.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.73 52.04 1.39 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.298 0.571 . . . . 0.0 109.785 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.4 mt -161.95 96.24 1.0 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.282 -179.215 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.18 78.74 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.737 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.566 ' O ' ' N ' ' A' ' 24' ' ' TYR . 2.5 m-80 -162.01 -79.14 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.292 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.51 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -22.75 -86.16 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.347 179.844 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.487 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 1.9 m -57.55 -52.38 65.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.163 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -53.84 -75.18 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.573 -179.103 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.566 ' N ' ' O ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -48.94 -57.13 6.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.724 -179.077 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 29' ' ' ASP . 34.6 m-20 -52.11 -56.44 14.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.336 -179.453 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.527 ' C ' ' H ' ' A' ' 28' ' ' LEU . 94.9 m -50.44 -53.06 32.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.029 0.442 . . . . 0.0 110.064 179.834 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -61.99 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.335 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.4 tt -163.68 -40.82 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -179.759 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -67.2 -40.07 86.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.754 0.312 . . . . 0.0 110.764 -179.707 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -112.72 15.49 19.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.544 179.486 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.7 m170 52.04 44.37 29.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.852 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.61 -154.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.896 0.379 . . . . 0.0 111.121 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.2 mtp85 -142.52 -2.99 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.831 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.3 p -175.32 -179.83 1.38 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.728 -179.94 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 156.73 167.95 18.68 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.337 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -178.51 174.99 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.903 0.382 . . . . 0.0 110.901 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -86.54 133.9 33.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.1 179.661 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -144.98 148.6 33.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.057 0.456 . . . . 0.0 111.44 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -75.44 -179.73 4.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.456 -179.531 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.517 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -154.85 -179.86 8.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.072 179.9 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -61.4 0.62 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.946 0.403 . . . . 0.0 110.462 -179.979 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.517 ' H ' ' C ' ' A' ' 40' ' ' ASP . 25.4 mtmm -102.2 -12.65 17.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.164 -179.886 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.477 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 15.7 ttp180 83.16 -5.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -95.6 156.13 16.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.435 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.8 mp -91.44 157.4 17.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.037 0.446 . . . . 0.0 111.775 -179.568 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -146.03 143.7 29.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.786 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.2 m -79.34 97.96 6.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.7 mt -87.06 126.09 40.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.9 m -98.84 111.75 24.05 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.955 179.421 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -95.22 131.64 41.05 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -103.98 -37.01 7.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.862 -179.281 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.44 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 1.4 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.706 -178.819 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 121.036 0.446 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 116.27 8.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.504 179.535 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.405 ' NZ ' ' OH ' ' A' ' 51' ' ' TYR . 11.2 pttm -152.46 135.99 16.04 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.253 -0.579 . . . . 0.0 112.1 -178.977 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.55 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -67.23 150.85 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.582 179.228 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.674 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -64.28 61.6 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.462 179.813 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 7' ' ' VAL . 2.8 mt-10 16.76 -140.65 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.38 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.78 12.52 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -178.202 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.623 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 67.3 t80 -50.98 143.11 16.14 Favored Pre-proline 0 N--CA 1.467 0.387 0 O-C-N 121.952 -0.468 . . . . 0.0 109.786 179.597 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.756 ' O ' HG23 ' A' ' 13' ' ' VAL . 9.4 Cg_endo -48.16 -88.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.876 1.717 . . . . 0.0 112.179 -179.596 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.756 HG23 ' O ' ' A' ' 12' ' ' PRO . 71.0 t 117.47 -8.12 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.638 1.175 . . . . 0.0 110.728 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 p -66.28 25.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.24 179.69 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.611 ' H ' ' C ' ' A' ' 13' ' ' VAL . 0.6 OUTLIER -172.02 99.57 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.96 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -171.25 27.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.815 -179.097 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.513 ' N ' ' CD ' ' A' ' 17' ' ' GLN . 1.7 mm100 -76.16 17.23 0.36 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.768 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' A' ' 16' ' ' CYS . 7.1 mt -163.42 -90.29 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.972 -179.848 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.92 -150.97 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.147 0.499 . . . . 0.0 110.995 -179.082 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.552 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.1 OUTLIER 67.0 -75.47 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.914 179.899 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.552 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 40.5 tp60 -38.13 -83.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 -179.667 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.623 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -57.68 -40.74 80.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 110.737 179.416 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.41 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 6.6 t-20 -56.66 -76.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.865 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.28 -40.38 24.67 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.845 179.946 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.439 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 65.6 m-20 -55.04 -68.52 0.18 Allowed 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.055 -179.787 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.674 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -54.52 -39.33 67.51 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.793 179.824 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? -60.77 6.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.088 179.723 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.486 ' H ' ' C ' ' A' ' 26' ' ' CYS . 17.4 tp -163.38 -36.77 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.546 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -67.68 -13.34 62.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.068 0.461 . . . . 0.0 110.351 -179.918 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -141.31 8.85 2.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.074 179.398 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 56.8 50.69 12.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.959 179.925 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.85 173.8 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.764 179.83 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -93.39 -51.2 5.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.294 179.886 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.3 p -160.96 126.57 3.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 179.871 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.41 ' O ' ' CG ' ' A' ' 23' ' ' ASN . . . -132.15 167.57 22.86 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.878 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -176.76 161.18 2.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.358 0.599 . . . . 0.0 111.003 -179.885 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -86.94 128.32 35.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.764 -179.737 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -125.62 148.75 48.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.043 0.449 . . . . 0.0 111.109 -179.725 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.625 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 25.2 m-85 -99.26 152.6 19.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.131 179.444 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 44' ' ' ASN . 0.3 OUTLIER -95.92 172.63 7.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.176 179.147 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -61.66 -2.02 0.71 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.035 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.434 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -97.59 -80.06 0.45 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.301 179.384 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.05 21.59 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.463 179.601 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.625 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -95.26 -165.1 1.24 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.767 0.318 . . . . 0.0 111.197 -179.964 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.551 HD11 ' CZ ' ' A' ' 39' ' ' TYR . 1.4 mt -146.22 147.06 31.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 0.0 111.057 -179.5 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -148.75 125.4 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 65.9 m -77.74 95.91 4.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.819 -179.92 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.436 HD13 HG12 ' A' ' 7' ' ' VAL . 3.3 mm -83.77 114.61 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.95 -179.428 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.5 m -106.04 111.84 24.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.317 178.984 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -96.82 153.85 17.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.064 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.405 ' OH ' ' NZ ' ' A' ' 6' ' ' LYS . 37.8 m-85 -121.06 -25.95 5.23 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.966 -178.889 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.465 0.281 0 CA-C-O 120.872 0.367 . . . . 0.0 111.245 -179.71 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.416 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.2 m . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 121.144 0.497 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 tptm -98.43 132.06 44.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.536 179.686 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -149.26 117.42 6.39 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.887 0.375 . . . . 0.0 111.516 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.4 143.41 15.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.16 -179.908 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.407 ' CD1' ' NZ ' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -86.34 109.42 18.98 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.025 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.505 ' O ' ' O ' ' A' ' 10' ' ' ASN . 2.5 mt-10 -55.1 -174.79 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.477 -178.916 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.505 ' O ' ' O ' ' A' ' 9' ' ' GLU . 5.5 p30 17.57 104.6 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.855 0.722 . . . . 0.0 111.923 -179.575 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.532 ' C ' ' H ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -179.86 81.57 0.19 Allowed Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.272 -179.636 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.52 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 52.7 Cg_exo -56.79 5.93 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 123.235 2.624 . . . . 0.0 113.822 -178.793 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.532 ' H ' ' C ' ' A' ' 11' ' ' TYR . 90.7 t 101.87 -72.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.201 1.001 . . . . 0.0 111.505 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.491 ' C ' ' O ' ' A' ' 13' ' ' VAL . 7.0 p 27.72 89.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 14' ' ' SER . 1.0 OUTLIER 92.86 -123.63 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.426 -179.426 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER 78.94 -49.18 0.43 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.528 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.88 -12.88 8.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.082 0.468 . . . . 0.0 110.659 -179.568 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.628 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 0.8 OUTLIER -71.82 -45.08 62.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.094 179.885 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 101.98 3.86 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 O-C-N 123.773 0.67 . . . . 0.0 110.802 -179.619 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.595 ' O ' ' N ' ' A' ' 22' ' ' CYS . 60.4 t30 -97.03 -118.24 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.744 179.81 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 20' ' ' ASN . 84.7 mm-40 -1.14 -65.31 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.952 0.782 . . . . 0.0 112.326 179.677 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.4 t -57.11 -69.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.93 179.887 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.41 ' N ' ' O ' ' A' ' 20' ' ' ASN . 25.0 t30 -50.45 -51.06 50.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.27 179.933 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.49 -47.31 76.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.64 179.367 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.429 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 97.3 m-20 -57.19 -55.3 36.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.871 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.888 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 57.0 m -56.06 -47.57 77.68 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.869 179.724 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.86 8.83 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.112 178.902 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.673 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -162.79 -132.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.677 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.558 ' H ' HD13 ' A' ' 28' ' ' LEU . 1.6 m-20 39.85 -77.2 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.461 0.476 . . . . 0.0 111.897 -179.889 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.673 ' N ' ' O ' ' A' ' 28' ' ' LEU . 12.6 mttp -91.99 -4.91 53.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.719 0.295 . . . . 0.0 110.981 -179.769 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.526 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 1.3 m-70 82.99 44.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.642 179.391 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.888 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -88.0 172.7 9.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.26 179.276 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -95.73 -29.25 14.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.009 0.433 . . . . 0.0 110.49 179.921 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.7 p -174.54 -164.67 0.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.653 179.882 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 168.54 -178.5 42.01 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.348 -179.909 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -178.22 160.7 1.38 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.868 0.366 . . . . 0.0 110.622 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 137.27 32.48 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.566 -179.81 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -146.39 131.78 18.61 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.147 0.499 . . . . 0.0 112.202 -179.405 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.535 ' CZ ' ' O ' ' A' ' 43' ' ' ARG . 1.2 m-85 -39.04 163.51 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.598 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 44' ' ' ASN . 19.5 p30 -136.87 -161.76 1.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.192 179.504 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -63.1 -28.33 70.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.146 -179.664 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 24.0 mmmt -99.67 28.17 4.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.186 -179.794 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.535 ' O ' ' CZ ' ' A' ' 39' ' ' TYR . 28.8 mtm180 59.74 5.8 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.433 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 31.7 m120 -94.96 145.94 24.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.968 0.413 . . . . 0.0 111.215 -179.7 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.743 ' H ' HD23 ' A' ' 45' ' ' LEU . 0.3 OUTLIER -91.34 120.79 32.52 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -178.622 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -98.61 148.57 23.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.542 178.306 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -78.58 98.14 6.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.629 -179.383 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.4 mt -87.83 116.73 30.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.25 179.397 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.6 m -96.52 120.89 37.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 179.924 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.418 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 5.8 t70 -97.25 134.59 40.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.359 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -104.65 -28.43 11.23 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.667 -178.943 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.416 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 0.0 111.384 -179.495 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.432 0.158 . . . . 0.0 111.044 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.481 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -140.47 151.14 44.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.939 0.4 . . . . 0.0 111.8 -179.363 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -148.89 133.75 17.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.504 -179.771 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.8 m -65.66 139.75 20.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.649 179.778 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.474 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -81.51 54.33 2.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.859 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.609 ' O ' ' N ' ' A' ' 11' ' ' TYR . 13.1 mt-10 25.22 -145.59 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.784 -179.968 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.46 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.5 OUTLIER -57.62 58.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.104 -179.51 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.609 ' N ' ' O ' ' A' ' 9' ' ' GLU . 35.4 t80 -56.19 121.33 41.16 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 110.513 -0.18 . . . . 0.0 110.513 179.424 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -41.02 90.12 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.547 1.498 . . . . 0.0 111.292 179.096 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.537 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -51.45 95.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.222 0.534 . . . . 0.0 111.11 -179.276 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 91.0 p -175.25 130.66 0.29 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.54 -179.903 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.498 ' O ' ' C ' ' A' ' 16' ' ' CYS . 26.8 mttt 87.96 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.764 0.665 . . . . 0.0 110.919 -179.537 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.498 ' C ' ' O ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER 25.2 98.01 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.344 0.403 . . . . 0.0 111.282 179.953 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.426 ' O ' ' C ' ' A' ' 18' ' ' LEU . 31.7 mt-30 -120.65 50.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 -179.981 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.617 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 26.1 mt 36.5 89.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.909 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 103.28 149.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 124.107 0.879 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.608 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.2 OUTLIER 84.46 -68.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 179.547 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.608 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 6.7 mm-40 -49.43 -79.06 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.672 0.272 . . . . 0.0 111.011 -179.542 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.1 m -55.23 -39.17 69.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.916 0.388 . . . . 0.0 110.52 179.956 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -55.65 -81.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.594 179.45 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.72 -46.8 30.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.232 -179.855 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.444 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 3.6 m-20 -51.82 -66.53 0.37 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.461 0.172 . . . . 0.0 110.93 -179.66 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.554 ' C ' ' H ' ' A' ' 28' ' ' LEU . 28.8 m -55.36 -36.54 66.44 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.384 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -60.48 6.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.17 179.297 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.554 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.5 tp -159.64 -34.16 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.288 -179.384 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -70.61 -56.82 5.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.004 0.43 . . . . 0.0 110.111 179.293 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 2.1 mptt -102.61 21.3 15.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.336 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.2 p-80 35.43 45.17 0.21 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.154 0.502 . . . . 0.0 110.796 -179.943 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.09 -132.79 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.608 179.798 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -139.32 -31.12 0.7 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.294 179.382 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.2 p -167.33 -164.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.796 -179.931 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.09 -171.31 44.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -177.15 154.33 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.852 0.358 . . . . 0.0 110.983 -179.969 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 92.2 m -85.52 96.71 9.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.566 179.976 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.419 ' HB2' HD12 ' A' ' 48' ' ' ILE . 37.0 m-85 -108.12 163.0 13.54 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.194 -179.872 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.57 ' CE2' HD23 ' A' ' 45' ' ' LEU . 27.5 m-85 -87.03 -22.77 25.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.769 179.745 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.506 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.1 OUTLIER 48.0 171.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.803 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.74 39.58 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.469 -179.681 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.489 ' H ' ' C ' ' A' ' 40' ' ' ASP . 16.2 mtmt -144.64 -1.76 0.88 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.563 -179.666 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 41.76 65.91 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.233 0.539 . . . . 0.0 109.934 -179.515 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -138.94 0.97 2.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.325 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.57 HD23 ' CE2' ' A' ' 39' ' ' TYR . 1.1 tm? 51.63 63.86 2.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.012 0.434 . . . . 0.0 110.377 179.218 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -95.03 169.86 9.82 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.418 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -96.69 114.58 26.23 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.404 -179.753 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.419 HD12 ' HB2' ' A' ' 38' ' ' PHE . 23.4 mt -90.6 132.09 36.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.542 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.9 m -100.95 112.86 25.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.753 179.482 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.603 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 6.8 t70 -94.09 151.94 19.13 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.726 179.829 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -124.0 -29.3 3.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.251 -178.783 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 35.1 m . . . . . 0 N--CA 1.463 0.193 0 CA-C-O 120.766 0.317 . . . . 0.0 111.143 -179.588 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 93.4 m . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.904 0.383 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' CD ' ' A' ' 5' ' ' LYS . 2.5 tmtt? -145.94 131.46 18.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.13 114.26 5.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.07 -179.949 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.417 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.0 OUTLIER -64.67 130.95 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.304 179.956 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.531 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -71.59 64.26 0.44 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.03 0.443 . . . . 0.0 110.344 179.781 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' N ' ' A' ' 11' ' ' TYR . 3.4 mt-10 29.26 -156.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.147 179.366 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -59.44 47.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.386 -179.315 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.605 ' O ' ' O ' ' A' ' 12' ' ' PRO . 58.2 t80 -52.25 145.3 19.45 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.183 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.605 ' O ' ' O ' ' A' ' 11' ' ' TYR . 73.8 Cg_exo -49.58 -139.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.895 1.73 . . . . 0.0 112.597 179.863 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.587 ' C ' ' H ' ' A' ' 15' ' ' LYS . 0.5 OUTLIER -179.26 -19.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.743 179.852 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.3 p -64.24 19.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -179.906 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.587 ' H ' ' C ' ' A' ' 13' ' ' VAL . 1.7 tttm -173.89 104.76 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.925 0.393 . . . . 0.0 111.502 -179.909 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.84 110.89 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.072 179.424 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -127.46 -54.02 1.35 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.822 -179.649 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.679 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 0.4 OUTLIER -179.31 89.44 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.794 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 96.71 174.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.491 0.662 . . . . 0.0 112.62 178.219 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 71.89 -78.31 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.819 179.265 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -39.04 -85.03 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.581 -179.051 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.8 m -58.15 -40.39 81.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.701 -179.346 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -52.98 -70.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.529 -179.506 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.572 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.55 -54.61 25.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.705 0.288 . . . . 0.0 111.114 -179.551 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.516 ' O ' ' N ' ' A' ' 29' ' ' ASP . 29.9 m-20 -49.57 -60.69 2.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.926 -179.514 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 37.9 m -54.98 -32.7 61.83 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.97 179.65 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.24 0.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.318 179.512 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -165.05 -37.12 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 -179.204 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.516 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -65.84 -16.87 64.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.767 0.318 . . . . 0.0 111.101 -179.314 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mmtt -142.6 5.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.967 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.8 36.9 19.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.767 179.897 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.38 -169.76 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.387 -179.744 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.434 ' H ' ' HA ' ' A' ' 51' ' ' TYR . 8.4 tpm_? -97.85 -20.9 17.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.655 179.992 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p 171.31 -163.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.334 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.65 -175.22 46.28 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.589 179.901 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -175.81 158.48 2.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 0.0 110.407 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 3.8 m -87.52 130.53 34.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.49 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -149.21 165.84 30.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.776 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.611 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.3 m-85 -81.88 166.86 19.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.35 179.705 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -124.38 87.08 2.66 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.162 0.506 . . . . 0.0 111.035 179.956 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' A' ' 40' ' ' ASP . 59.1 mt-10 21.25 41.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.5 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.605 ' N ' ' O ' ' A' ' 40' ' ' ASP . 5.0 ttmm -147.13 -76.47 0.18 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.949 0.404 . . . . 0.0 110.979 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 162.71 58.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.558 -179.959 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.611 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 20.2 m-80 -141.01 -164.05 1.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.337 -179.684 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.3 tp -152.64 82.77 1.23 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.857 -179.656 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -92.33 165.63 12.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.21 -179.73 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.0 110.47 22.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.342 -179.696 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.575 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.9 mp -89.22 122.25 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.209 179.541 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -93.57 113.39 25.49 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.902 0.382 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -95.2 139.83 30.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.889 -179.819 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.434 ' HA ' ' H ' ' A' ' 33' ' ' ARG . 67.6 m-85 -106.95 -11.95 15.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.167 -179.62 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.5 m . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.263 -179.448 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.911 0.386 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.4 122.56 40.58 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.905 179.12 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -148.78 144.49 27.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 111.206 -179.064 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.509 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 21.7 m -62.24 162.25 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 CA-C-O 121.165 0.507 . . . . 0.0 111.068 179.52 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.539 ' CD1' ' C ' ' A' ' 8' ' ' TYR . 3.5 p90 -67.71 -29.56 68.84 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.799 -179.653 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.548 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER 26.81 101.87 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.538 -177.458 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.548 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 11.9 m120 104.91 79.76 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.832 179.903 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.55 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.7 t80 170.42 96.47 0.04 OUTLIER Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.512 179.125 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.579 ' O ' ' N ' ' A' ' 14' ' ' SER . 96.1 Cg_exo -44.86 112.1 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.208 1.938 . . . . 0.0 112.399 -179.996 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.59 73.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.429 -179.838 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.579 ' N ' ' O ' ' A' ' 12' ' ' PRO . 9.2 p -63.79 -24.4 67.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.634 179.641 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -173.48 165.11 4.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.159 179.645 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -173.42 10.37 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -89.0 -33.44 17.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 0.0 110.719 179.863 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.58 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 3.3 mt -70.89 -58.61 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.547 -179.941 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.58 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 105.35 59.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.884 0.74 . . . . 0.0 110.974 -179.256 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.54 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 16.4 p30 -155.35 -51.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.702 179.695 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.54 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -47.93 -76.74 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.475 179.926 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.55 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -59.74 -42.38 93.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.734 0.302 . . . . 0.0 110.939 179.789 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 52.1 t30 -54.7 -76.97 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.106 179.883 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.95 -37.81 21.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.346 179.832 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.598 ' O ' ' N ' ' A' ' 29' ' ' ASP . 68.0 m-20 -55.5 -69.58 0.13 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.655 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.52 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -51.66 -38.16 53.65 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.904 179.828 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.408 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 3.5 mtpt -57.93 3.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.117 179.368 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.52 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.01 -43.64 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.864 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.598 ' N ' ' O ' ' A' ' 25' ' ' ASP . 84.2 m-20 -68.17 -8.08 35.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.699 0.285 . . . . 0.0 111.301 -179.429 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -140.29 13.32 2.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.779 179.925 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 22.0 m170 59.94 38.17 21.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.977 179.321 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.49 -166.13 1.52 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.649 179.181 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.408 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 46.7 ttt180 -129.54 -48.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.972 0.415 . . . . 0.0 110.448 179.558 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.447 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 1.1 p -158.53 124.39 4.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.268 179.531 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.445 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -130.18 -176.53 14.46 Favored Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.38 -0.914 . . . . 0.0 113.649 -179.234 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -174.93 158.77 2.59 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.537 0.208 . . . . 0.0 110.776 179.929 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 139.03 30.93 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.606 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -149.29 154.34 38.87 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.511 ' HB3' HD12 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -163.52 172.58 14.22 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.902 -179.43 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.524 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -139.4 -160.65 1.09 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.818 0.342 . . . . 0.0 111.241 -178.964 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.473 ' CG ' ' O ' ' A' ' 41' ' ' GLU . 38.5 tt0 -60.05 3.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.115 -179.417 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.541 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.3 OUTLIER -94.18 4.65 53.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.233 0.539 . . . . 0.0 109.925 179.48 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 46.33 10.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.015 -179.8 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.541 ' H ' ' C ' ' A' ' 42' ' ' LYS . 84.5 m-20 -94.68 97.19 9.91 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.143 0.497 . . . . 0.0 110.274 179.462 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.511 HD12 ' HB3' ' A' ' 39' ' ' TYR . 6.4 tp -89.47 130.31 35.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.677 -178.942 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -137.28 154.57 50.08 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.152 -179.009 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -92.94 111.78 23.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.33 179.834 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.5 mm -80.46 109.94 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.365 179.059 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 m -96.87 115.35 27.27 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.47 0.481 . . . . 0.0 110.721 -179.444 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' A' ' 34' ' ' SER . 1.0 OUTLIER -95.24 131.83 40.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.176 -179.67 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -101.9 -17.4 16.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.178 -179.42 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.489 -179.977 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.489 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.5 m . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.543 0.211 . . . . 0.0 110.938 . . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.7 137.77 32.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.481 -179.606 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -149.22 123.01 9.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.497 179.681 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.15 142.63 16.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -81.26 103.16 10.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.435 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.54 ' O ' ' C ' ' A' ' 10' ' ' ASN . 15.4 mm-40 -59.54 168.28 1.67 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.399 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.54 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 11.42 108.21 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.849 0.718 . . . . 0.0 111.883 -179.567 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -177.97 143.48 0.48 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.698 -179.789 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.414 ' C ' ' O ' ' A' ' 11' ' ' TYR . 33.0 Cg_exo -28.98 83.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.179 2.586 . . . . 0.0 113.316 -179.686 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.571 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -58.26 -39.48 73.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.148 179.468 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.23 -39.25 94.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.208 -179.763 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 91.29 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.914 0.388 . . . . 0.0 110.868 -179.908 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.46 ' HA ' HE21 ' A' ' 21' ' ' GLN . 0.1 OUTLIER -172.86 111.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.392 -179.689 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.512 ' H ' HE21 ' A' ' 21' ' ' GLN . 1.8 mt-30 -149.13 -22.4 0.3 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.504 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.486 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -166.22 176.73 7.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.212 0.529 . . . . 0.0 111.518 -179.27 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.475 ' C ' ' OD1' ' A' ' 20' ' ' ASN . . . -58.71 103.45 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.85 -179.999 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.547 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.6 p-10 176.24 -88.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.973 178.982 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.518 ' OE1' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -27.57 -85.63 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.418 -0.113 . . . . 0.0 111.231 -179.84 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.565 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 0.8 OUTLIER -52.33 -56.58 13.9 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.6 0.238 . . . . 0.0 111.269 -179.77 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -49.05 -74.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.102 0.477 . . . . 0.0 110.49 179.968 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.547 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -49.84 -42.49 47.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.399 179.685 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 29' ' ' ASP . 69.1 m-20 -55.19 -66.47 0.4 Allowed 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.649 -179.688 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 1.8 m -52.69 -39.68 62.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.26 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tptm -57.16 2.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.151 179.849 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.499 ' H ' ' C ' ' A' ' 26' ' ' CYS . 64.0 tp -163.78 -37.56 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -66.81 -51.62 53.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.891 0.377 . . . . 0.0 110.505 179.926 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.519 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -106.12 6.48 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.306 179.8 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.519 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 47.12 49.28 15.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.703 -179.859 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.523 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.55 -127.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.444 179.37 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.25 -42.89 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.993 0.425 . . . . 0.0 110.623 179.924 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -158.43 -163.51 1.29 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.32 179.964 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.407 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . 167.14 174.69 36.53 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.525 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -175.57 168.73 3.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.778 0.323 . . . . 0.0 110.561 -179.951 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.5 m -88.06 147.49 24.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.277 -179.469 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -146.93 131.41 17.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.606 179.812 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.617 ' CD1' ' O ' ' A' ' 44' ' ' ASN . 21.1 m-85 -74.14 -172.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.399 -179.444 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.502 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 0.8 OUTLIER -163.47 -171.48 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.882 -179.932 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.13 -20.0 63.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.261 -179.638 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 43' ' ' ARG . 19.7 mmtt -99.43 29.11 4.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.046 179.871 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LYS . 11.9 ttt180 35.76 34.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.83 -179.957 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.617 ' O ' ' CD1' ' A' ' 39' ' ' TYR . 1.0 OUTLIER -94.6 -162.84 0.98 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 -179.949 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.0 mt -146.22 100.06 3.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 110.991 -179.58 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -92.96 149.69 21.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 179.842 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.51 110.31 22.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.116 -179.552 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.407 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 9.6 mm -87.95 128.26 40.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 179.984 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 61.1 m -108.39 116.65 32.36 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 179.513 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.523 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -94.82 133.39 38.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.915 0.388 . . . . 0.0 110.116 179.324 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -100.66 -33.8 10.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.2 -178.751 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.489 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.654 -179.8 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.531 0.228 0 CA-C-O 121.298 0.571 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -143.97 92.96 2.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.71 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -96.3 127.46 42.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.691 0.281 . . . . 0.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.2 m -66.03 133.65 30.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 112.091 -179.787 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.483 ' O ' ' O ' ' A' ' 9' ' ' GLU . 13.5 t80 -77.09 93.84 3.94 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.688 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' O ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -47.96 -179.21 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.303 -177.922 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.579 ' O ' ' O ' ' A' ' 9' ' ' GLU . 43.5 m-20 16.34 109.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.675 0.609 . . . . 0.0 111.987 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.674 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 12.8 t80 -173.07 144.52 1.18 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.144 -179.071 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.93 ' O ' HG23 ' A' ' 13' ' ' VAL . 81.2 Cg_exo -43.56 -134.86 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 123.108 2.539 . . . . 0.0 113.831 -179.378 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 12' ' ' PRO . 2.2 t -177.46 -56.52 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.879 -179.031 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.8 p -60.08 66.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.865 -178.729 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.697 ' O ' ' N ' ' A' ' 17' ' ' GLN . 4.5 mttm -174.47 -68.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.29 179.201 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.721 ' O ' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER 13.04 -66.5 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 178.94 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.697 ' N ' ' O ' ' A' ' 15' ' ' LYS . 23.4 mt-30 -54.65 51.52 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.638 0.586 . . . . 0.0 111.842 -178.744 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.721 ' N ' ' O ' ' A' ' 16' ' ' CYS . 11.7 mt -165.45 98.79 0.7 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.606 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.51 86.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.849 -179.424 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.612 ' O ' ' N ' ' A' ' 22' ' ' CYS . 3.7 t-20 -173.51 -78.12 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.816 -179.757 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.607 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER -60.46 41.4 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.521 -179.921 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 15.6 m -170.23 -59.01 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.147 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 27' ' ' LYS . 1.0 OUTLIER -56.69 -54.54 45.03 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.576 178.112 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.544 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.92 -47.91 76.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.028 178.957 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.628 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.0 m-20 -58.09 -68.75 0.22 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.409 -179.983 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.504 ' C ' ' H ' ' A' ' 28' ' ' LEU . 56.2 m -51.87 -41.46 61.89 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.023 -179.94 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.455 ' CG ' ' O ' ' A' ' 27' ' ' LYS . 17.0 tttp -59.83 6.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.08 179.776 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.2 tp -164.68 -41.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.532 -0.467 . . . . 0.0 112.121 -179.396 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.628 ' N ' ' O ' ' A' ' 25' ' ' ASP . 55.4 m-20 -69.27 -12.98 62.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.29 -179.746 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.548 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 1.1 mptm? -138.19 6.05 2.56 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.831 0.348 . . . . 0.0 110.639 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.548 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 52.38 35.52 17.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.231 0.539 . . . . 0.0 110.447 -179.818 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.53 -167.22 1.76 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.649 179.702 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.01 -31.04 13.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.11 0.481 . . . . 0.0 109.856 179.63 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -171.93 -175.16 1.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.836 179.719 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.429 ' N ' ' HA ' ' A' ' 23' ' ' ASN . . . -152.11 95.23 0.15 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 119.965 -1.112 . . . . 0.0 113.519 -179.733 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.598 ' CG ' ' H ' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -74.76 -159.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.369 0.604 . . . . 0.0 111.894 179.775 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -153.25 137.69 16.73 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.305 179.559 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -150.71 158.91 44.71 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -178.538 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.764 ' CG ' ' N ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -169.75 -153.71 0.11 Allowed 'General case' 0 C--N 1.343 0.318 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.228 179.548 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.764 ' N ' ' CG ' ' A' ' 39' ' ' TYR . 0.2 OUTLIER 175.12 95.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.63 0.252 . . . . 0.0 111.131 179.333 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.411 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 8.5 mt-10 87.11 -70.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.704 179.565 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.642 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -150.38 29.23 0.71 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -179.665 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.643 ' C ' ' H ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -65.11 16.19 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.954 -179.328 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.642 ' H ' ' C ' ' A' ' 42' ' ' LYS . 30.4 m120 63.15 -15.82 0.06 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.261 -179.919 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.656 HD12 ' N ' ' A' ' 46' ' ' GLN . 4.3 tp 59.5 133.43 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.904 177.873 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.656 ' N ' HD12 ' A' ' 45' ' ' LEU . 1.8 mp0 -141.34 165.05 28.59 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.555 0.693 . . . . 0.0 112.571 -178.514 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.674 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 63.0 m -80.65 110.15 15.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.037 -179.965 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.423 ' O ' ' N ' ' A' ' 36' ' ' GLU . 1.4 mp -93.6 126.23 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.888 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 98.5 m -88.98 117.23 27.84 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.439 179.688 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -93.48 121.13 34.57 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.386 179.481 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -100.38 -17.36 17.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.931 -179.121 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.7 m . . . . . 0 C--N 1.33 -0.265 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.142 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.162 0 CA-C-O 120.704 0.288 . . . . 0.0 111.481 . . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -90.86 133.63 35.08 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.196 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.79 122.56 10.57 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.087 178.786 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.0 m -60.87 145.33 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 0.0 111.561 -179.695 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.523 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -87.64 60.35 5.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.001 179.418 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.552 ' C ' ' H ' ' A' ' 11' ' ' TYR . 35.5 mt-10 30.57 -158.61 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.021 179.707 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.54 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.5 OUTLIER -58.48 34.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.649 -179.149 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.677 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 5.5 t80 -50.92 135.16 28.22 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.486 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.447 ' C ' ' O ' ' A' ' 11' ' ' TYR . 39.9 Cg_exo -30.95 84.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.329 2.02 . . . . 0.0 112.318 179.512 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.605 ' N ' ' O ' ' A' ' 11' ' ' TYR . 42.9 t -55.77 -15.64 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.956 -179.536 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.4 p -62.16 -93.71 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.8 -179.196 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -67.82 153.25 44.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.331 0.586 . . . . 0.0 112.35 -178.793 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -174.52 -67.99 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.471 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.413 ' O ' ' C ' ' A' ' 18' ' ' LEU . 6.0 mm100 56.37 28.17 13.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.016 0.436 . . . . 0.0 111.065 179.59 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.659 HD23 ' H ' ' A' ' 37' ' ' CYS . 40.4 mt 35.59 75.9 0.05 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.22 179.542 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -178.56 -147.94 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.343 179.719 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.635 ' ND2' ' OE1' ' A' ' 21' ' ' GLN . 21.8 t30 -21.14 -107.96 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.453 -179.377 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.635 ' OE1' ' ND2' ' A' ' 20' ' ' ASN . 4.6 mm100 -5.81 -73.88 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.245 -179.575 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.6 t -57.5 -68.61 0.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.478 179.923 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -48.38 -59.5 3.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 -179.69 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.422 179.583 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.636 ' O ' ' N ' ' A' ' 29' ' ' ASP . 22.4 m-20 -50.93 -60.53 2.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.29 179.751 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.2 m -53.1 -53.98 42.3 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.714 179.278 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 14.27 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.672 -179.832 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.735 ' C ' HD13 ' A' ' 28' ' ' LEU . 2.8 tm? -165.02 -52.19 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 119.876 -0.729 . . . . 0.0 112.613 -179.483 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.636 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -66.05 -15.72 63.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.574 0.226 . . . . 0.0 111.094 -179.06 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -134.31 13.16 3.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.733 0.301 . . . . 0.0 110.834 -179.973 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.4 m80 46.29 36.46 3.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.947 -179.955 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.4 -172.93 4.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.76 179.892 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -95.96 -45.31 6.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.889 179.959 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.3 p -177.55 154.74 1.01 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.534 179.833 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.63 -164.87 16.34 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.125 -1.036 . . . . 0.0 113.254 -179.684 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -177.19 175.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.699 0.285 . . . . 0.0 110.448 -179.864 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.659 ' H ' HD23 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -88.19 149.49 23.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.135 0.493 . . . . 0.0 111.918 -179.834 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' A' ' 37' ' ' CYS . 26.5 m-85 -148.91 145.68 27.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.168 179.388 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.501 ' O ' ' O ' ' A' ' 44' ' ' ASN . 17.0 m-85 -73.79 -102.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -179.522 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.463 ' CG ' ' O ' ' A' ' 39' ' ' TYR . 0.6 OUTLIER 48.97 -167.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.264 0.554 . . . . 0.0 111.086 -179.788 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER 27.64 63.17 0.1 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.307 -178.85 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.513 ' O ' ' N ' ' A' ' 44' ' ' ASN . 5.5 ttpt 69.68 65.95 0.25 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 178.655 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.475 ' HD3' ' H ' ' A' ' 43' ' ' ARG . 8.7 mmt85 32.76 33.51 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.558 178.986 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.513 ' N ' ' O ' ' A' ' 42' ' ' LYS . 10.5 m-20 -95.64 129.93 42.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 178.891 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.08 86.38 7.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.13 0.49 . . . . 0.0 110.988 -179.574 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -89.64 158.46 17.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.658 179.832 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.677 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -99.67 108.94 21.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.641 -179.506 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.2 mt -85.83 110.22 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.076 179.498 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.2 m -97.34 121.96 39.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.538 179.438 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.477 ' OD2' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -98.91 134.86 41.17 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.516 0.674 . . . . 0.0 110.859 179.791 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -121.0 66.41 0.86 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.28 -178.917 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.477 ' SG ' ' OD2' ' A' ' 50' ' ' ASP . 77.8 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.777 0.322 . . . . 0.0 111.457 -179.709 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.136 0 CA-C-O 120.666 0.27 . . . . 0.0 110.283 . . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.654 ' CD ' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -97.87 145.37 26.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.069 0.462 . . . . 0.0 111.039 179.904 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -153.95 110.3 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.763 179.864 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -61.31 137.06 24.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.9 0.381 . . . . 0.0 111.656 -179.869 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.514 ' O ' ' C ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -64.51 66.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.598 179.056 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 7' ' ' VAL . 12.6 mp0 17.21 -115.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.415 178.99 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.542 ' O ' ' C ' ' A' ' 11' ' ' TYR . 7.8 m-20 -50.34 -72.22 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.784 -179.816 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.663 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 2.4 t80 10.89 79.24 0.06 OUTLIER Pre-proline 0 N--CA 1.466 0.365 0 O-C-N 123.791 0.682 . . . . 0.0 112.147 -178.836 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -46.54 -53.35 6.16 Favored 'Trans proline' 0 CA--C 1.518 -0.304 0 C-N-CA 122.877 2.385 . . . . 0.0 112.524 -179.675 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.49 ' O ' ' C ' ' A' ' 14' ' ' SER . 1.2 t 173.58 -50.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.52 179.615 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.551 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 5.5 p 23.05 55.23 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.875 -179.812 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.551 ' CB ' ' O ' ' A' ' 14' ' ' SER . 28.1 tptt 92.86 141.0 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.489 179.559 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.1 m -174.35 21.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.959 179.795 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -101.03 44.65 1.0 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.342 0.592 . . . . 0.0 110.702 -179.783 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.9 mt -158.84 -129.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.449 179.744 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.43 46.66 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.531 -179.653 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.509 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.1 OUTLIER -141.33 -47.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.611 179.795 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.509 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 5.7 tp60 -47.96 -80.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.835 179.904 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.663 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 22.5 m -62.48 -33.67 75.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.385 -179.902 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 3.0 t-20 -53.46 -65.79 0.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.014 0.435 . . . . 0.0 109.87 179.29 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.569 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.05 -38.58 68.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.071 178.968 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 29' ' ' ASP . 25.2 m-20 -52.45 -63.45 1.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.397 179.622 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.433 ' C ' ' H ' ' A' ' 28' ' ' LEU . 36.8 m -55.27 -39.31 69.68 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.08 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -59.37 3.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.586 -179.6 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' A' ' 26' ' ' CYS . 36.1 tp -165.93 -33.2 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.582 ' N ' ' O ' ' A' ' 25' ' ' ASP . 4.7 m-20 -65.83 -16.7 64.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.893 0.378 . . . . 0.0 110.487 -179.656 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.1 mtpm? -144.57 0.29 0.99 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.032 179.801 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m80 62.39 39.08 12.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.455 179.719 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.894 ' HB2' ' CZ ' ' A' ' 51' ' ' TYR . . . -86.81 -171.02 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.676 179.538 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.475 ' HD2' ' H ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -89.28 -39.0 13.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.768 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.479 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.3 p -175.85 -147.33 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.294 179.666 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.494 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . 149.24 173.48 19.9 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.555 -0.831 . . . . 0.0 113.36 179.952 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.45 ' CD ' ' O ' ' A' ' 35' ' ' GLY . 1.3 pm0 -175.11 172.41 2.81 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.683 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 145.64 25.61 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.663 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -145.15 149.34 34.82 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.35 179.551 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.604 ' CZ ' HD11 ' A' ' 45' ' ' LEU . 26.5 m-85 -80.54 150.44 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 111.355 -179.637 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 43' ' ' ARG . 24.8 p30 -99.12 -178.17 3.85 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.144 -179.863 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -63.01 -12.15 24.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.509 -179.477 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -94.92 -77.28 0.47 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.233 179.526 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.402 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 3.1 ptp180 175.45 1.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.329 -0.851 . . . . 0.0 112.161 179.482 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -93.97 151.64 19.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 111.316 -179.366 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.675 ' N ' HD12 ' A' ' 45' ' ' LEU . 2.9 mp -91.02 153.9 19.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.201 -179.707 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -144.52 132.7 21.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.278 179.689 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 83.8 m -81.35 105.58 12.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 112.073 -179.005 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.1 mt -88.47 120.73 37.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.188 179.43 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.2 m -92.67 119.38 32.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.402 178.889 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.747 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 20.5 t0 -86.63 144.93 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.514 -179.303 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.894 ' CZ ' ' HB2' ' A' ' 32' ' ' ALA . 83.6 m-85 -138.84 42.15 2.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.36 -178.793 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.475 ' H ' ' HD2' ' A' ' 33' ' ' ARG . 71.0 m . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.666 -178.869 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.463 0.215 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -142.58 103.61 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.65 0.262 . . . . 0.0 110.465 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -142.05 131.67 24.01 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.219 0.533 . . . . 0.0 111.635 -179.502 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.781 HG23 ' H ' ' A' ' 9' ' ' GLU . 2.4 m -66.57 153.19 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.107 178.745 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.585 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.4 OUTLIER -81.81 36.3 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.086 0.47 . . . . 0.0 110.154 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.781 ' H ' HG23 ' A' ' 7' ' ' VAL . 2.3 pt-20 10.86 -100.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.946 179.066 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 11' ' ' TYR . 2.7 m120 -43.22 -72.45 0.06 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.501 -178.767 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.529 ' C ' ' O ' ' A' ' 10' ' ' ASN . 33.5 t80 16.57 102.12 0.02 OUTLIER Pre-proline 0 N--CA 1.469 0.508 0 O-C-N 123.471 0.482 . . . . 0.0 111.819 -178.93 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -42.6 93.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.319 2.012 . . . . 0.0 112.936 -179.568 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.9 t -56.2 96.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.9 p -178.57 23.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.119 179.633 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -174.45 107.71 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.378 -179.987 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -170.25 -10.58 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.156 -179.373 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -62.57 19.69 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.757 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.623 ' H ' ' C ' ' A' ' 16' ' ' CYS . 14.0 mt -164.73 134.32 3.73 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.741 0.305 . . . . 0.0 110.324 179.954 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.428 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.16 -176.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 0.0 111.265 179.652 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.4 OUTLIER 81.9 -78.34 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.753 -179.828 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.49 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -29.15 -83.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.079 179.982 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.39 -46.07 91.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.061 0.458 . . . . 0.0 110.926 179.548 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.441 ' HA ' ' H ' ' A' ' 35' ' ' GLY . 0.1 OUTLIER -52.82 -75.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.22 -179.634 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.516 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -47.43 -47.19 26.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.869 -179.947 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.583 ' O ' ' N ' ' A' ' 29' ' ' ASP . 88.7 m-20 -52.12 -73.64 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.575 -179.248 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -51.59 -38.29 53.82 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.913 -179.833 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.405 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 64.9 tttt -63.15 7.18 0.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.964 179.392 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.478 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.8 tt -161.96 -22.29 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.859 -179.529 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -69.32 -55.59 10.01 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.025 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -101.17 3.44 41.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.134 179.312 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.9 m80 70.66 45.29 0.59 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.665 -179.547 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.49 -143.95 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.32 -179.717 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 50' ' ' ASP . 0.6 OUTLIER -142.54 -31.68 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.136 179.977 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 p -157.52 117.69 3.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.819 0.343 . . . . 0.0 111.876 -179.635 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.441 ' H ' ' HA ' ' A' ' 23' ' ' ASN . . . -104.6 71.86 0.25 Allowed Glycine 0 C--N 1.337 0.584 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.596 179.731 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -73.25 179.5 3.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.116 0.484 . . . . 0.0 111.816 -179.998 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -148.17 142.51 26.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.941 179.587 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -148.7 143.41 26.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -178.769 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.479 ' CD1' ' C ' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -169.71 159.01 7.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.195 -1.366 . . . . 0.0 109.841 179.034 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -96.62 -82.51 0.4 Allowed 'General case' 0 CA--C 1.502 -0.87 0 CA-C-O 121.214 0.53 . . . . 0.0 111.91 -178.966 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.487 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -165.48 8.26 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.515 -179.657 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.414 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -98.12 2.93 49.1 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.768 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.414 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER 80.69 21.13 0.45 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.201 179.917 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -94.14 74.46 4.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-O 121.604 0.716 . . . . 0.0 109.845 179.001 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.2 tp -97.81 139.1 34.18 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.517 -1.22 . . . . 0.0 112.6 -178.09 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -141.85 144.89 34.1 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.022 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -97.38 110.1 22.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.808 -179.835 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -87.71 112.21 23.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 179.774 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.2 m -105.85 104.37 14.07 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.291 179.929 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 33' ' ' ARG . 4.3 t70 -96.16 136.18 36.97 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.008 179.275 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -101.84 -24.45 14.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.7 -178.548 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.136 179.803 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.941 0.401 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -97.07 146.16 25.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.487 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 mtpm? -150.33 121.34 7.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.994 0.426 . . . . 0.0 111.376 -179.942 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.428 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.0 OUTLIER -66.04 151.3 10.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.902 179.407 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.555 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.6 OUTLIER -83.88 81.88 8.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.687 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 17.0 pt-20 -61.61 72.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.616 -179.495 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.579 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 31.4 t30 127.04 101.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.511 1.132 . . . . 0.0 110.527 -179.871 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -179.3 134.15 0.28 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.61 ' O ' ' N ' ' A' ' 14' ' ' SER . 89.0 Cg_endo -79.58 122.54 5.05 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.171 1.914 . . . . 0.0 112.553 -179.972 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.6 t -61.16 43.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.243 179.606 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.61 ' N ' ' O ' ' A' ' 12' ' ' PRO . 10.1 p -62.6 -110.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.952 0.406 . . . . 0.0 111.434 -179.502 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -67.59 23.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.41 -179.633 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -66.04 -26.06 67.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.751 179.736 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -67.38 12.67 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.973 -179.806 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.53 ' H ' ' C ' ' A' ' 16' ' ' CYS . 16.8 mt -162.89 124.34 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.426 -179.862 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.04 107.37 0.35 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -174.56 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.267 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -46.13 -64.66 0.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.355 -179.652 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 t -56.11 -53.52 56.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.274 -179.545 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -51.68 -72.59 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.931 -179.845 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.81 -44.57 28.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.437 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 7.2 m-20 -55.51 -74.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.498 -179.542 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.508 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 0.5 OUTLIER -52.17 -34.09 43.49 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.164 -179.658 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.21 1.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.263 179.34 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.493 ' H ' ' C ' ' A' ' 26' ' ' CYS . 57.9 tp -162.92 -29.82 0.04 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.991 -179.728 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.06 -48.58 57.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.765 0.317 . . . . 0.0 110.692 179.846 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -100.2 18.03 19.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.938 -179.918 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.1 m170 55.43 44.74 26.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 -179.727 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -87.4 -160.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.493 -179.732 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.507 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 40.4 ttm-85 -139.01 -27.3 0.82 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 -179.856 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 1.5 p -178.64 120.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.126 179.712 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -118.91 179.37 16.79 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.363 -179.271 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -178.71 145.71 0.31 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.65 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.93 131.37 34.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.833 0.349 . . . . 0.0 111.181 -179.675 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.438 ' O ' HD12 ' A' ' 45' ' ' LEU . 51.3 m-85 -146.7 171.35 15.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.303 -179.653 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -86.13 134.53 33.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.225 179.318 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 42' ' ' LYS . 2.4 p-10 -142.07 -83.23 0.19 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.19 0.519 . . . . 0.0 112.165 -179.101 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.434 ' H ' ' CG ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -59.72 70.47 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.221 -178.095 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.4 mptt 53.81 85.07 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.536 179.252 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.652 ' H ' ' HE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER 57.92 18.49 5.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.756 179.109 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.479 ' O ' ' OD1' ' A' ' 40' ' ' ASP . 3.3 m120 -93.8 115.75 28.18 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 179.327 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.438 HD12 ' O ' ' A' ' 38' ' ' PHE . 21.2 tp -82.75 93.07 7.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.407 -179.026 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -100.94 -178.92 3.9 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.39 179.87 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -104.79 104.07 13.79 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.491 -179.568 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.821 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.0 OUTLIER -88.65 109.53 20.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.511 179.305 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.0 m -96.95 119.18 34.94 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.774 0.321 . . . . 0.0 111.267 -179.709 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.503 ' CB ' ' O ' ' A' ' 34' ' ' SER . 2.2 t0 -94.48 137.08 34.05 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.185 0.517 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.507 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 5.6 m-85 -103.61 -17.89 14.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.46 179.996 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.0 m . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.972 -179.59 . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.126 0 CA-C-O 120.855 0.36 . . . . 0.0 110.558 . . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.41 ' O ' ' CE ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -147.08 145.55 29.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.998 179.972 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HZ1' ' CD ' ' A' ' 9' ' ' GLU . 8.3 tttp -146.73 116.86 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.128 0.49 . . . . 0.0 110.861 -179.777 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -63.25 142.75 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.456 -179.573 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.563 ' C ' ' H ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -62.78 110.95 1.91 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.833 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.455 ' C ' ' OD1' ' A' ' 10' ' ' ASN . 26.7 mt-10 -60.65 5.86 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.398 -178.674 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.563 ' H ' ' C ' ' A' ' 8' ' ' TYR . 1.8 p-10 172.2 122.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.8 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.627 ' O ' ' N ' ' A' ' 13' ' ' VAL . 19.8 t80 -179.72 123.54 0.23 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.089 179.955 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.14 76.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.397 2.065 . . . . 0.0 113.138 -179.634 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.627 ' N ' ' O ' ' A' ' 11' ' ' TYR . 1.4 p -58.68 97.15 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.144 0.497 . . . . 0.0 110.981 179.849 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.533 ' C ' ' H ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -178.0 -57.78 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.778 -179.867 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.553 ' C ' ' H ' ' A' ' 17' ' ' GLN . 13.7 tttp -67.21 10.25 0.17 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.666 179.987 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.533 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -67.61 19.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.233 -179.921 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.688 ' C ' HD12 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -88.33 56.32 3.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 110.875 -179.682 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.688 HD12 ' C ' ' A' ' 17' ' ' GLN . 5.5 mp -161.92 -122.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.671 179.737 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 174.01 28.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 -179.688 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 21' ' ' GLN . 29.1 t-20 -131.19 -52.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.486 179.961 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.42 ' C ' ' O ' ' A' ' 20' ' ' ASN . 11.0 mm100 -37.19 -86.87 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.916 -179.764 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.8 m -59.87 -37.33 79.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.536 0.208 . . . . 0.0 111.326 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.485 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 13.5 t-20 -56.28 -75.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.68 0.276 . . . . 0.0 110.954 179.788 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.512 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -48.86 -43.57 38.93 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.906 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.509 ' O ' ' N ' ' A' ' 29' ' ' ASP . 10.7 m-20 -51.89 -57.36 9.61 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.684 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.3 m -53.62 -44.55 69.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.406 0.622 . . . . 0.0 109.464 178.801 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -62.51 7.51 0.07 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 113.165 -178.78 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.87 -37.65 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.933 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.509 ' N ' ' O ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -66.79 -12.55 59.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.769 0.319 . . . . 0.0 111.081 -179.259 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -144.63 10.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.082 179.768 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.7 m80 54.9 46.8 23.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.555 -179.883 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.6 -174.19 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.382 -179.664 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.401 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 0.9 OUTLIER -96.66 -59.63 1.77 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.229 179.586 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.449 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 3.9 p -158.05 114.05 2.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.694 179.991 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.485 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -105.62 164.26 13.99 Favored Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.142 -179.618 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -176.43 167.66 2.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.982 0.42 . . . . 0.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.4 m -89.29 130.01 35.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.278 -179.716 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -148.22 161.98 40.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.955 179.898 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.58 ' O ' ' N ' ' A' ' 41' ' ' GLU . 75.4 m-85 -91.2 115.28 27.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.816 179.799 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.492 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 6.8 p-10 -57.11 77.12 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.51 0.671 . . . . 0.0 110.492 179.854 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 39' ' ' TYR . 34.4 mt-10 27.87 40.57 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.688 -1.142 . . . . 0.0 112.177 -179.724 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -142.23 -81.83 0.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.099 178.807 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 10.1 mtp180 160.74 23.73 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.97 179.789 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.474 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 98.9 m-20 -97.65 -13.61 21.42 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.591 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.514 HD13 ' CZ ' ' A' ' 39' ' ' TYR . 5.9 tp 57.68 122.19 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.644 0.259 . . . . 0.0 111.15 -179.665 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.474 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -149.54 -179.14 6.86 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.423 179.107 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.524 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 36.3 m -102.07 139.14 38.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 14.5 mt -139.4 121.21 16.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 0.0 112.052 -178.884 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 m -92.63 124.11 36.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.018 178.468 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' A' ' 34' ' ' SER . 9.0 t70 -88.49 124.38 33.93 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.126 0.489 . . . . 0.0 111.192 -179.319 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -115.18 50.2 1.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.311 -179.383 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 69.4 m . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.542 179.916 . . . . . . . . 0 0 . 1 . 043 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.815 0.34 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 043 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 135.5 26.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.436 179.924 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -149.79 121.87 8.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.913 0.387 . . . . 0.0 111.285 179.829 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -61.85 161.98 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.179 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.233 179.782 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.424 ' CD1' ' HB2' ' A' ' 11' ' ' TYR . 0.2 OUTLIER -113.15 84.49 2.01 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.473 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -57.94 -79.62 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.146 -178.174 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.604 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 63.8 t30 -38.96 -38.88 0.48 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.696 -178.416 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' HB2' ' CD1' ' A' ' 8' ' ' TYR . 53.0 t80 -52.87 124.84 37.56 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.585 -178.939 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.562 ' C ' ' H ' ' A' ' 14' ' ' SER . 73.0 Cg_exo -46.35 112.32 0.45 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 122.148 1.898 . . . . 0.0 112.579 179.567 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.3 p -60.59 7.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.477 179.598 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.562 ' H ' ' C ' ' A' ' 12' ' ' PRO . 5.1 p -60.66 -108.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.558 -179.252 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 ttpm? -63.44 149.74 45.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 -179.527 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -171.94 3.92 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.608 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -86.62 -32.24 20.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.978 -179.892 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.576 ' C ' ' H ' ' A' ' 20' ' ' ASN . 1.3 mm? -68.86 116.26 9.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.726 -179.415 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.19 39.06 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.076 179.161 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.576 ' H ' ' C ' ' A' ' 18' ' ' LEU . 1.7 t-20 -136.71 -108.04 0.2 Allowed 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.941 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.555 ' C ' ' O ' ' A' ' 20' ' ' ASN . 4.9 mm-40 0.9 -80.59 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.069 0.547 . . . . 0.0 112.439 179.182 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.0 t -58.01 -58.07 10.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.889 179.848 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 20' ' ' ASN . 19.3 t-20 -52.83 -56.96 11.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.459 179.957 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -53.14 -52.52 58.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.352 179.46 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.8 m-20 -50.99 -50.16 58.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.29 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.496 ' C ' ' H ' ' A' ' 28' ' ' LEU . 1.2 m -51.83 -54.26 30.96 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.447 0.641 . . . . 0.0 109.331 178.696 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -61.25 14.75 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.683 -179.806 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.54 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -167.2 -53.63 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.378 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -65.81 -13.26 59.15 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.569 0.223 . . . . 0.0 111.483 -178.884 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 31' ' ' HIS . 3.0 mmmp? -139.79 24.02 2.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.009 0.433 . . . . 0.0 110.776 179.875 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.441 ' C ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 34.0 38.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.089 179.636 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.76 179.99 6.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.909 0.385 . . . . 0.0 110.937 179.923 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 mmm-85 -92.27 -27.19 17.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.266 0.555 . . . . 0.0 109.837 179.724 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.6 p 178.37 -168.09 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.836 179.629 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.41 -177.16 47.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.352 179.975 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.45 -154.42 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -179.836 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.94 142.86 30.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.733 0.301 . . . . 0.0 110.574 179.493 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.492 ' O ' HD12 ' A' ' 45' ' ' LEU . 66.5 m-85 -146.88 164.41 32.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.124 0.487 . . . . 0.0 111.585 -179.41 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.405 ' CE2' HD13 ' A' ' 45' ' ' LEU . 22.2 m-85 -101.59 119.3 38.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.078 -179.8 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.591 ' C ' ' H ' ' A' ' 42' ' ' LYS . 11.4 p-10 -51.75 168.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.623 179.703 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -64.22 36.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.495 -179.835 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 40' ' ' ASP . 3.6 mmtp -146.86 -81.25 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.171 179.625 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -176.82 20.7 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.112 179.677 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.78 124.66 46.75 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.65 179.527 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 38' ' ' PHE . 51.6 tp -89.51 138.48 31.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.389 179.424 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -147.61 145.8 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 111.63 -179.459 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -82.67 109.02 16.48 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.929 -179.96 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.9 mt -90.3 116.88 32.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.912 0.387 . . . . 0.0 111.86 -179.925 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.47 120.1 36.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.685 179.412 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.28 136.28 34.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.958 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -111.16 -6.34 14.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.598 -179.29 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.7 m . . . . . 0 C--O 1.232 0.178 0 CA-C-O 121.035 0.445 . . . . 0.0 111.822 -179.294 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.65 0 CA-C-O 120.85 0.357 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -79.82 5.54 13.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.113 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.489 ' HZ3' ' HB2' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -153.84 151.7 29.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.624 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.51 21.7 0.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.692 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.67 122.48 13.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.752 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.93 125.48 45.94 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.436 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.573 ' O ' ' N ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -67.07 127.86 29.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.32 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.535 ' O ' ' C ' ' A' ' 9' ' ' GLU . 2.9 t80 -61.25 73.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 7' ' ' VAL . 15.0 mp0 16.36 -125.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.67 0.606 . . . . 0.0 111.139 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 57.8 t-20 -57.21 -122.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 6.5 t80 97.64 95.67 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.609 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.24 115.47 1.75 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 121.786 1.658 . . . . 0.0 111.486 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 15' ' ' LYS . 68.0 t -50.69 -50.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.884 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 69.6 p 19.12 -79.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.502 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 13' ' ' VAL . 21.3 tptp -65.44 -87.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.155 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.468 ' C ' ' O ' ' A' ' 15' ' ' LYS . 2.2 m 28.1 81.3 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 121.021 0.438 . . . . 0.0 111.625 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -142.26 -23.73 0.67 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.689 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.425 ' O ' ' O ' ' A' ' 19' ' ' ALA . 1.4 mt -165.17 -176.41 4.08 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.366 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -54.73 -157.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.118 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 21' ' ' GLN . 10.7 t-20 76.38 -87.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.104 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.448 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -30.29 -90.37 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.729 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.6 m -55.68 -45.42 77.79 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 1.7 t-20 -51.83 -71.74 0.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.428 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -49.91 -59.52 3.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.359 -179.452 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.9 m-20 -49.17 -54.75 14.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.505 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.0 m -54.74 -41.98 71.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -62.14 10.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.012 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.672 ' O ' HD23 ' A' ' 28' ' ' LEU . 6.0 tt -165.49 -45.52 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.615 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 9.9 m-20 -67.16 -15.26 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.082 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -141.37 30.07 1.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.0 0.428 . . . . 0.0 110.808 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.453 ' C ' ' O ' ' A' ' 30' ' ' LYS . 4.5 m80 32.42 39.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.242 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 30' ' ' LYS . . . -87.69 -176.64 5.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.827 0.346 . . . . 0.0 111.037 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.96 -38.28 11.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.328 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -163.61 -157.08 0.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.401 179.595 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.519 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 163.07 169.21 26.17 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.143 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -178.05 170.2 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 55.4 m -86.7 127.39 34.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.767 0.318 . . . . 0.0 110.484 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.41 ' HB2' HD13 ' A' ' 48' ' ' ILE . 39.2 m-85 -142.12 165.98 25.95 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.373 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.475 ' HB2' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -145.1 -178.1 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.856 179.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -121.79 -178.29 3.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.072 -179.906 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.32 42.97 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.399 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.539 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER -138.44 -25.29 0.93 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.932 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.539 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 2.2 tpt180 89.63 61.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.27 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 43' ' ' ARG . 4.9 m-20 -142.87 105.73 4.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.583 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.484 ' O ' HG22 ' A' ' 13' ' ' VAL . 35.8 mt -86.57 136.2 33.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.543 0.687 . . . . 0.0 112.566 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.494 ' O ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -145.67 153.87 41.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.22 179.4 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.535 ' SG ' ' CZ ' ' A' ' 11' ' ' TYR . 1.8 m -75.89 101.37 5.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.368 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 46' ' ' GLN . 2.1 mp -89.27 121.7 39.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.796 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.3 m -95.64 117.3 30.21 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.52 133.86 34.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.0 0.429 . . . . 0.0 111.542 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -103.63 -25.71 13.07 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.18 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.89 86.67 1.8 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.952 0.406 . . . . 0.0 111.159 -179.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -167.71 59.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.056 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.025 179.8 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.584 0 CA-C-O 120.868 0.366 . . . . 0.0 111.342 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.452 ' CG ' ' N ' ' A' ' 3' ' ' LYS . 5.7 p-10 -61.98 -55.08 33.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.202 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.452 ' N ' ' CG ' ' A' ' 2' ' ' ASP . 3.3 ttpp 51.64 94.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.974 0.416 . . . . 0.0 110.884 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 175.2 18.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.367 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -95.81 139.46 32.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.998 0.427 . . . . 0.0 111.275 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -140.39 101.83 4.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.818 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.442 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -61.8 130.39 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.814 -178.924 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.477 ' O ' ' C ' ' A' ' 9' ' ' GLU . 1.1 t80 -72.66 67.33 0.77 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.477 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.0 mt-10 32.11 -149.7 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.302 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.587 ' CG ' ' H ' ' A' ' 11' ' ' TYR . 9.3 p30 -50.9 -67.33 0.26 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.401 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.587 ' H ' ' CG ' ' A' ' 10' ' ' ASN . 23.4 t80 99.4 128.72 0.02 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 C-N-CA 123.306 0.643 . . . . 0.0 110.585 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.714 ' O ' HG23 ' A' ' 13' ' ' VAL . 72.6 Cg_exo -44.92 -69.16 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 121.353 1.369 . . . . 0.0 111.759 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.779 ' O ' HG12 ' A' ' 13' ' ' VAL . 66.2 t 110.44 18.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.801 1.313 . . . . 0.0 110.148 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.29 -21.52 65.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.639 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.94 141.04 0.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.923 0.392 . . . . 0.0 111.098 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -176.65 58.67 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.467 0.651 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.496 ' C ' HD12 ' A' ' 18' ' ' LEU . 95.1 mm-40 -106.58 -22.72 12.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.704 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.496 HD12 ' C ' ' A' ' 17' ' ' GLN . 3.6 mp -163.38 170.47 17.46 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.466 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 113.02 1.51 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.668 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 15.9 t30 -178.77 -95.9 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.172 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -46.11 -53.63 9.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.888 0.375 . . . . 0.0 110.319 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.1 t -60.55 -55.91 27.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.741 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -52.95 -65.98 0.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.468 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.531 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.29 -47.28 36.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.616 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.5 m-20 -53.55 -62.21 1.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.76 0.314 . . . . 0.0 110.531 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.48 ' C ' ' H ' ' A' ' 28' ' ' LEU . 99.3 m -54.4 -41.02 68.8 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.135 0.493 . . . . 0.0 109.968 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 5.24 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.917 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.48 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.4 tp -163.22 -47.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.375 -0.53 . . . . 0.0 112.256 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.616 ' N ' ' O ' ' A' ' 25' ' ' ASP . 72.9 m-20 -66.01 -10.95 44.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.241 0.543 . . . . 0.0 109.655 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 31' ' ' HIS . 4.2 tptt -143.33 9.79 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.067 179.234 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.43 ' C ' ' O ' ' A' ' 30' ' ' LYS . 3.3 p80 35.2 43.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.83 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.43 -166.21 1.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.835 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -33.95 11.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.626 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -174.06 -154.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.701 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.46 ' C ' ' OE1' ' A' ' 36' ' ' GLU . . . 152.73 179.65 28.45 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.532 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.46 ' OE1' ' C ' ' A' ' 35' ' ' GLY . 6.7 pm0 -177.53 175.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.671 -0.265 . . . . 0.0 110.307 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.09 148.94 22.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 0.0 111.4 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -146.61 146.02 30.28 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.434 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.483 ' CE1' HD22 ' A' ' 45' ' ' LEU . 11.2 m-85 -76.87 151.44 35.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.103 0.478 . . . . 0.0 111.867 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -101.33 -179.89 4.16 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.759 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -64.7 -7.84 12.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.077 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.32 -80.4 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.08 32.68 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.75 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -128.87 144.53 51.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.82 0.343 . . . . 0.0 111.044 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.483 HD22 ' CE1' ' A' ' 39' ' ' TYR . 0.1 OUTLIER -90.74 148.06 22.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.126 0.489 . . . . 0.0 111.162 -179.802 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -141.78 147.51 37.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.061 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.691 ' C ' HD12 ' A' ' 48' ' ' ILE . 0.8 OUTLIER -70.9 143.21 51.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 112.127 -179.214 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.691 HD12 ' C ' ' A' ' 47' ' ' CYS . 2.0 mp -136.1 115.23 16.12 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.128 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.3 m -91.85 124.71 36.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.493 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -92.98 127.69 38.58 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.878 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -104.52 -3.33 24.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.135 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.1 m -114.91 -105.4 0.4 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.973 0.416 . . . . 0.0 111.06 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.591 ' CD ' ' H ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -165.67 -146.75 0.09 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.581 -179.736 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.591 ' H ' ' CD ' ' A' ' 53' ' ' GLU . 43.4 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.939 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PCA . . . . . 0.506 ' O ' ' OD1' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.445 -0.693 0 CA-C-O 121.124 0.488 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.525 ' CG ' ' N ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER 83.0 -160.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.028 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.525 ' N ' ' CG ' ' A' ' 2' ' ' ASP . 1.2 mmtm 55.4 151.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.165 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.42 -25.42 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.331 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.416 ' HB3' ' HZ2' ' A' ' 5' ' ' LYS . 0.6 OUTLIER -90.23 136.49 33.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.428 -178.829 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -149.9 123.53 9.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.986 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.64 145.1 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.351 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.562 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.2 t80 -92.29 74.5 5.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.818 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.562 ' O ' ' O ' ' A' ' 8' ' ' TYR . 25.8 mt-10 21.12 110.15 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.789 0.681 . . . . 0.0 112.72 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.503 ' C ' ' O ' ' A' ' 9' ' ' GLU . 3.9 t30 15.67 56.94 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.204 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.646 ' CD2' ' SG ' ' A' ' 47' ' ' CYS . 87.4 t80 -54.13 110.15 1.94 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.023 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.606 ' O ' ' N ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.05 117.2 1.77 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.833 1.689 . . . . 0.0 112.148 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.406 ' H ' HG23 ' A' ' 13' ' ' VAL . 2.4 t -60.2 41.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.065 -179.668 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.606 ' N ' ' O ' ' A' ' 12' ' ' PRO . 25.2 p -63.68 -32.3 73.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.862 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -172.56 141.52 1.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.294 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -173.09 0.07 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -87.49 46.73 1.41 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.532 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 1.8 mt -167.48 -95.85 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.262 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 170.81 -165.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.827 0.346 . . . . 0.0 110.146 -178.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.584 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.7 t30 60.6 -74.55 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.515 ' N ' ' O ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -35.62 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 109.969 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.71 -45.44 92.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.449 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -56.81 -76.2 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.088 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.584 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -42.3 -41.01 2.64 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.634 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.489 ' O ' ' N ' ' A' ' 29' ' ' ASP . 1.2 m-20 -52.88 -61.51 2.25 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.481 ' C ' ' H ' ' A' ' 28' ' ' LEU . 73.4 m -51.79 -47.33 64.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.501 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -61.18 12.22 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.674 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.8 tt -166.6 -37.88 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -66.62 -14.57 62.59 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.692 -179.378 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -143.2 3.55 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.2 m170 63.51 43.35 5.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.723 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.677 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -88.48 -178.55 5.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.011 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.435 ' HE ' ' C ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -92.82 -35.09 13.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.321 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.7 p -172.37 -159.59 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.928 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.17 175.59 23.96 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.83 -1.176 . . . . 0.0 113.524 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG3' ' CE2' ' A' ' 38' ' ' PHE . 3.1 pt-20 -178.59 165.97 1.73 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.502 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.7 OUTLIER -88.16 146.62 25.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.011 0.434 . . . . 0.0 111.514 -179.159 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CE2' ' HG3' ' A' ' 36' ' ' GLU . 33.8 m-85 -144.84 160.03 41.94 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.312 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 40' ' ' ASP . 7.6 m-85 -94.38 86.62 4.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.717 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.581 ' OD2' ' NE2' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -42.34 167.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.776 0.322 . . . . 0.0 110.342 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.01 -0.32 0.68 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.93 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -110.46 17.63 20.6 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? 60.62 61.45 1.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.156 0.503 . . . . 0.0 110.595 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.483 ' O ' ' OD1' ' A' ' 40' ' ' ASP . 87.4 m-20 -147.12 129.74 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.681 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 39' ' ' TYR . 4.7 mt -85.43 100.73 12.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.581 ' NE2' ' OD2' ' A' ' 40' ' ' ASP . 72.1 mt-30 -113.53 145.96 40.39 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.467 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.1 m -82.5 101.49 10.74 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.982 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 mp -88.42 111.77 22.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 82.7 m -93.85 125.3 38.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.266 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.677 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 65.3 t0 -95.19 140.74 29.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.959 0.409 . . . . 0.0 110.91 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.51 ' CE2' ' HB2' ' A' ' 32' ' ' ALA . 55.8 m-85 -128.91 66.8 1.42 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.323 -178.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.447 ' O ' ' C ' ' A' ' 53' ' ' GLU . 72.7 m -98.98 34.26 2.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.048 0.451 . . . . 0.0 110.875 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.541 ' N ' ' CD ' ' A' ' 53' ' ' GLU . 0.1 OUTLIER -34.87 -48.43 0.39 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.865 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.845 179.924 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.586 0 CA-C-O 120.777 0.322 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.5 p-10 -89.4 -44.31 10.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.706 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.403 ' NZ ' ' OE1' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -135.17 28.33 3.44 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.108 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.503 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.7 m 53.77 41.11 32.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.234 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.95 136.48 24.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 111.068 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -151.83 133.19 14.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.142 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.407 HG13 ' H ' ' A' ' 7' ' ' VAL . 1.4 m -65.72 152.56 9.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.367 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.446 ' C ' ' CD1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER -94.47 98.08 10.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.552 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -66.28 116.03 6.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.581 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.409 ' HB2' ' CE1' ' A' ' 8' ' ' TYR . 28.5 t-20 -178.45 -98.58 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.136 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.8 149.79 15.81 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.583 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.495 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 72.3 Cg_endo -75.16 10.91 1.62 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.464 2.109 . . . . 0.0 111.721 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.721 ' O ' HG12 ' A' ' 13' ' ' VAL . 97.8 t 102.06 2.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 124.72 1.262 . . . . 0.0 110.586 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.554 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 24.8 p -60.73 -75.08 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.554 ' N ' ' OG ' ' A' ' 14' ' ' SER . 29.6 mttm -66.96 102.58 1.0 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.225 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -172.37 28.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.416 -179.423 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -115.12 37.8 3.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.255 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 20' ' ' ASN . 0.5 OUTLIER -169.37 119.16 0.67 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.792 0.33 . . . . 0.0 111.159 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.23 52.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.165 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 18' ' ' LEU . 56.8 t-20 -140.87 -82.37 0.23 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.725 0.298 . . . . 0.0 111.24 -179.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 38.5 tp60 -38.19 -61.69 0.64 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.911 0.386 . . . . 0.0 110.826 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.81 -54.62 39.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.251 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -54.45 -64.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.792 0.329 . . . . 0.0 110.247 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 0.4 OUTLIER -50.64 -39.76 51.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.89 179.238 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.1 m-20 -55.36 -58.5 7.47 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.464 ' C ' ' H ' ' A' ' 28' ' ' LEU . 61.7 m -52.39 -43.55 64.82 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -59.62 7.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.583 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.7 tp -166.35 -37.02 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.515 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.5 m-20 -66.16 -13.27 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.371 . . . . 0.0 110.739 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -142.34 0.4 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.1 m80 64.33 45.43 3.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.945 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.75 -178.46 5.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.255 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.64 -32.01 12.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.305 0.574 . . . . 0.0 110.065 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.2 p 178.07 146.12 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.536 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.94 -177.16 23.7 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.845 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -178.62 168.63 1.75 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 0.0 110.918 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.8 m -88.8 132.22 34.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.437 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -143.79 164.83 29.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.534 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -91.41 104.52 17.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.996 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.529 ' C ' ' H ' ' A' ' 42' ' ' LYS . 8.9 p-10 -92.34 -177.48 4.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.041 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -63.29 39.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.616 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 21.11 1.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.869 0.366 . . . . 0.0 110.612 179.665 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 40.54 39.83 0.8 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.159 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -144.49 159.8 42.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.569 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.573 ' O ' HG13 ' A' ' 13' ' ' VAL . 9.6 mt -85.4 94.98 9.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.688 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -90.47 139.94 30.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.396 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -83.8 93.77 8.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.9 mt -83.47 118.04 30.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.931 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 8' ' ' TYR . 39.7 m -97.61 112.98 24.63 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.392 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -95.15 132.33 40.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 110.666 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.31 -42.69 7.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.548 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.609 ' O ' ' N ' ' A' ' 54' ' ' TYR . 23.0 m -108.7 -112.78 0.3 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.652 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.403 ' OE1' ' NZ ' ' A' ' 3' ' ' LYS . 12.4 tp10 38.8 -85.02 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.03 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.609 ' N ' ' O ' ' A' ' 52' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.305 -0.855 . . . . 0.0 110.35 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.575 0 CA-C-O 120.882 0.372 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.94 13.76 21.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt -119.01 123.14 43.79 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.671 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -164.36 -86.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.11 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.85 135.57 35.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.99 0.424 . . . . 0.0 111.235 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -147.89 130.52 15.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.104 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -64.44 127.68 25.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.502 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.607 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 28.8 t80 -74.56 2.55 9.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.253 0.549 . . . . 0.0 110.527 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.56 ' O ' ' C ' ' A' ' 10' ' ' ASN . 9.9 pt-20 32.54 -154.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.676 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.56 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 11.89 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.457 0.473 . . . . 0.0 111.676 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.438 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 4.6 t80 -176.81 133.23 0.38 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.099 -179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.586 ' O ' ' N ' ' A' ' 14' ' ' SER . 61.0 Cg_endo -71.0 47.28 0.73 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.128 1.885 . . . . 0.0 112.135 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.515 ' C ' ' O ' ' A' ' 12' ' ' PRO . 2.8 t 12.02 54.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.713 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 12' ' ' PRO . 74.8 p -63.58 -125.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.7 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 32.4 mttm -67.45 161.28 25.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.64 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 1.3 m -173.42 93.89 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.386 0.613 . . . . 0.0 111.34 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.475 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 3.1 mm-40 156.46 -48.02 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.782 -1.099 . . . . 0.0 108.888 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.6 mt -75.59 125.47 29.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.732 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.86 92.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.367 . . . . 0.0 110.672 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.551 ' CG ' ' H ' ' A' ' 21' ' ' GLN . 19.4 t-20 -173.43 -121.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.551 ' H ' ' CG ' ' A' ' 20' ' ' ASN . 14.3 mm-40 -5.17 -79.45 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.918 0.761 . . . . 0.0 112.412 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -55.72 31.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.447 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 20' ' ' ASN . 35.0 t30 -53.13 -61.62 2.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.346 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.74 -57.62 8.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -50.1 -53.67 25.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.218 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.653 ' C ' ' H ' ' A' ' 28' ' ' LEU . 84.0 m -57.69 -47.13 83.21 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.457 ' HE3' ' ND2' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -61.24 11.0 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.119 178.454 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.678 ' O ' ' N ' ' A' ' 30' ' ' LYS . 9.1 tp -161.14 -137.5 0.04 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 52.25 -78.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.678 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -101.32 -4.6 26.74 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 177.631 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.46 ' N ' ' O ' ' A' ' 28' ' ' LEU . 6.3 m80 70.19 65.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.263 178.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.21 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.264 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.498 HH21 ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.08 -34.03 10.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.293 0.568 . . . . 0.0 109.654 179.472 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.498 ' CB ' HH21 ' A' ' 33' ' ' ARG . 96.5 p -176.51 -169.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.035 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -153.76 174.12 32.36 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.108 -1.044 . . . . 0.0 113.349 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.86 143.51 0.43 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.519 ' HB3' HD22 ' A' ' 45' ' ' LEU . 99.5 m -90.05 157.18 17.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.062 0.458 . . . . 0.0 111.985 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -147.24 142.28 27.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.851 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -86.29 173.19 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 111.618 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.584 ' C ' ' H ' ' A' ' 42' ' ' LYS . 29.1 p-10 -118.89 178.88 4.32 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.737 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.67 25.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.959 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.584 ' H ' ' C ' ' A' ' 40' ' ' ASP . 14.3 tppt? -145.26 -77.78 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.968 0.413 . . . . 0.0 109.932 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.614 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -179.12 12.57 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.29 179.762 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.433 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 0.6 OUTLIER -90.7 133.51 35.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.942 0.401 . . . . 0.0 110.673 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.519 HD22 ' HB3' ' A' ' 37' ' ' CYS . 6.4 mt -90.93 160.27 15.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -141.96 136.01 29.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.038 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.93 100.42 12.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.471 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.461 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.2 mp -89.62 116.41 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.594 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -94.78 119.26 33.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.652 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -94.07 123.17 37.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.571 0.7 . . . . 0.0 111.876 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.41 ' O ' ' HB2' ' A' ' 33' ' ' ARG . 11.8 m-85 -97.31 -94.43 0.22 Allowed 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.563 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.1 m 52.22 23.57 2.42 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.007 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 71.1 tt0 -41.25 101.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.095 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.508 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 CA-C-O 120.775 0.322 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -166.1 86.19 0.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 mttt 64.84 164.99 0.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.006 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.04 37.36 0.12 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.715 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.08 126.96 11.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.883 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.57 137.24 16.94 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.486 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.64 146.65 11.82 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.155 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.492 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.5 t80 -73.36 -16.12 61.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.361 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.642 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 88.23 143.34 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.643 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.493 ' C ' ' O ' ' A' ' 9' ' ' GLU . 13.6 t-20 15.33 46.61 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.926 0.766 . . . . 0.0 112.508 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.642 ' N ' ' O ' ' A' ' 9' ' ' GLU . 39.0 t80 -59.05 122.6 64.17 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.892 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -41.43 86.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.944 1.763 . . . . 0.0 112.031 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.55 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -53.17 97.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.039 0.447 . . . . 0.0 111.392 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -177.59 -82.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.333 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -68.71 99.33 1.0 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.601 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.552 ' HB3' HD12 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -172.59 105.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.494 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 169.37 36.11 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -166.6 145.29 5.44 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.887 0.375 . . . . 0.0 111.103 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.63 55.32 0.01 OUTLIER 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.237 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.601 ' N ' ' O ' ' A' ' 18' ' ' LEU . 7.1 t-20 -148.75 -115.06 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.604 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.554 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.2 mp0 3.41 -79.76 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 123.74 0.65 . . . . 0.0 112.241 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -56.11 26.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.928 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.7 OUTLIER -53.12 -61.26 2.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.319 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.537 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.45 -54.52 26.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.363 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.0 m-20 -51.35 -66.42 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.315 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.537 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.6 m -47.23 -43.92 22.24 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.94 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -59.48 8.71 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.924 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.9 tp -164.28 -36.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.942 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.482 ' N ' ' O ' ' A' ' 25' ' ' ASP . 15.4 m-20 -70.23 -21.42 63.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.862 0.363 . . . . 0.0 110.875 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' CG ' ' OH ' ' A' ' 51' ' ' TYR . 3.8 tptp -136.11 5.69 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.061 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.53 31.91 20.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.795 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.695 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.33 -177.73 6.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.93 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -99.08 -23.88 15.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.637 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.7 p -175.06 -165.32 0.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.864 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.53 -175.7 46.57 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.55 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -175.96 146.44 0.7 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.928 0.394 . . . . 0.0 111.316 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.24 105.83 18.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.462 ' CD2' HD12 ' A' ' 48' ' ' ILE . 41.0 m-85 -99.85 125.19 45.77 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.003 0.43 . . . . 0.0 112.082 -179.168 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.615 ' CE1' HD22 ' A' ' 45' ' ' LEU . 74.6 m-85 -73.98 174.36 8.7 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.103 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 3.0 p30 -173.52 156.15 2.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.748 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.478 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.2 pt-20 16.45 -74.53 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.872 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -99.09 45.43 1.0 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.382 -179.148 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.572 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 23.5 66.0 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.808 179.612 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.91 ' C ' HD23 ' A' ' 45' ' ' LEU . 4.6 m-20 -97.75 -3.76 38.42 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.415 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.91 HD23 ' C ' ' A' ' 44' ' ' ASN . 1.2 pt? 36.74 93.83 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.21 0.529 . . . . 0.0 112.018 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mp0 -94.12 138.11 32.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.803 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.449 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -77.0 98.11 4.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.809 -178.858 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.462 HD12 ' CD2' ' A' ' 38' ' ' PHE . 5.5 mt -86.51 114.56 26.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.708 179.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 65.6 m -91.31 117.73 29.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.467 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.695 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 6.6 t70 -95.26 127.83 41.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.0 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.454 ' OH ' ' CG ' ' A' ' 30' ' ' LYS . 39.4 m-85 -97.47 4.82 50.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.727 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.4 m -140.25 -76.22 0.33 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.408 . . . . 0.0 110.435 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.578 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 1.0 OUTLIER 50.85 16.1 0.3 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.028 179.693 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.198 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.582 0 CA-C-O 120.797 0.332 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.501 ' O ' ' O ' ' A' ' 3' ' ' LYS . 25.1 t70 53.38 41.37 32.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.501 ' O ' ' O ' ' A' ' 2' ' ' ASP . 20.1 mttp 42.5 104.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.274 0.559 . . . . 0.0 111.29 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.24 20.05 13.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.767 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.8 141.04 27.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.976 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 134.68 24.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.958 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -61.48 131.67 26.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.681 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.6 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -67.14 -3.03 6.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.498 ' O ' ' O ' ' A' ' 10' ' ' ASN . 4.9 mt-10 90.46 -123.41 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.905 0.753 . . . . 0.0 110.398 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.569 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 10.5 m120 -53.47 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.269 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.569 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 24.1 t80 102.29 137.94 0.01 OUTLIER Pre-proline 0 N--CA 1.47 0.55 0 O-C-N 123.73 0.644 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.58 83.95 1.66 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.096 1.864 . . . . 0.0 112.226 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.435 ' CG1' HD23 ' A' ' 45' ' ' LEU . 3.0 t -52.61 106.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.002 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.6 p -173.51 -80.17 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.928 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -65.99 -17.79 64.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.911 0.386 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.497 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -65.15 84.07 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.46 179.832 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.2 mm-40 -132.85 -11.39 3.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.316 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.8 mt -165.48 167.08 17.87 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.935 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.541 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -57.28 137.1 56.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.58 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.554 ' CG ' ' N ' ' A' ' 21' ' ' GLN . 1.6 t-20 150.45 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.257 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.554 ' N ' ' CG ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -50.03 -55.18 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.217 179.847 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.0 t -59.45 -54.62 44.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -52.11 -67.84 0.22 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.762 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.558 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.11 -46.65 53.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.963 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.1 m-20 -49.2 -61.24 2.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.533 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.497 ' C ' ' H ' ' A' ' 28' ' ' LEU . 92.2 m -55.03 -42.73 72.98 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.587 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -60.17 7.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.323 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.2 tp -164.42 -20.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 25' ' ' ASP . 2.0 m-20 -68.27 -64.52 0.85 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.781 0.324 . . . . 0.0 110.648 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mttp -101.06 12.66 37.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.65 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.8 m170 68.3 39.35 2.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.194 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -87.72 -177.04 5.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.907 0.384 . . . . 0.0 111.323 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.67 -37.74 11.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.502 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.582 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.7 p -177.64 -140.33 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.627 0.251 . . . . 0.0 110.786 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.582 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 124.53 -159.31 19.16 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.727 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.77 171.8 2.18 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.35 131.83 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 111.567 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.502 ' O ' HD12 ' A' ' 45' ' ' LEU . 70.4 m-85 -149.42 -171.19 3.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.241 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.595 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 6.6 m-85 -90.65 141.61 28.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.944 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.572 ' C ' ' H ' ' A' ' 42' ' ' LYS . 1.3 p-10 -99.3 171.2 8.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.356 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -64.19 36.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.382 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.572 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.6 OUTLIER -143.01 8.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.057 0.456 . . . . 0.0 110.316 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' C ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 59.93 58.86 2.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.571 -179.726 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 2.3 m120 -143.82 -138.18 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.056 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.636 ' O ' ' NE2' ' A' ' 46' ' ' GLN . 27.0 tp -155.12 129.25 8.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.88 0.372 . . . . 0.0 111.414 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.636 ' NE2' ' O ' ' A' ' 45' ' ' LEU . 3.3 mp0 -145.76 175.81 10.12 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.214 0.531 . . . . 0.0 111.105 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.414 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -95.25 103.47 15.33 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.092 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.3 mm -83.2 113.1 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 111.011 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -95.91 125.42 40.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.433 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.57 ' OD1' ' N ' ' A' ' 51' ' ' TYR . 61.5 t0 -94.29 143.09 26.69 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.503 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.57 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 81.7 m-85 -129.32 31.33 4.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.302 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -94.57 -82.25 0.37 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.063 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.535 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 1.0 OUTLIER 86.28 -67.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.899 0.381 . . . . 0.0 110.288 -179.316 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.852 179.556 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.625 0 CA-C-O 120.876 0.369 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.5 ' O ' ' C ' ' A' ' 3' ' ' LYS . 3.2 p-10 -138.99 -117.79 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.181 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.515 ' C ' ' H ' ' A' ' 5' ' ' LYS . 66.8 mttt 23.12 83.28 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 O-C-N 123.398 0.436 . . . . 0.0 111.536 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.5 m -64.29 5.74 0.24 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.187 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.515 ' H ' ' C ' ' A' ' 3' ' ' LYS . 2.5 tptt -138.76 127.37 23.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.194 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -144.87 110.02 5.15 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.101 0.477 . . . . 0.0 111.417 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.5 m -69.36 143.49 14.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.522 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.517 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.7 OUTLIER -89.86 71.76 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.002 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.94 71.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.321 -178.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.531 ' O ' ' C ' ' A' ' 11' ' ' TYR . 28.9 t-20 177.94 -79.16 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.536 179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.548 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.3 t80 -0.42 114.4 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.448 0 O-C-N 123.915 0.759 . . . . 0.0 112.438 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.431 ' O ' ' N ' ' A' ' 14' ' ' SER . 86.8 Cg_exo -44.11 98.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.442 ' H ' HG23 ' A' ' 13' ' ' VAL . 2.0 t -54.29 87.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.933 0.396 . . . . 0.0 111.131 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.453 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 1.7 p -176.2 139.44 0.36 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.557 ' C ' ' H ' ' A' ' 17' ' ' GLN . 0.5 OUTLIER 84.2 8.54 0.52 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -67.95 21.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.814 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.557 ' H ' ' C ' ' A' ' 15' ' ' LYS . 1.6 mp0 -94.93 18.27 12.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 mt -166.96 147.03 5.56 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.012 0.434 . . . . 0.0 111.18 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.444 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.52 -178.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.967 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.615 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.5 OUTLIER 80.22 -72.42 0.07 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.757 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 2.0 mp0 -54.91 77.07 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.359 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ASN . 66.8 m 125.98 -54.29 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.601 1.16 . . . . 0.0 109.04 -178.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -55.16 -54.91 37.24 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.453 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -56.18 -53.86 52.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.977 178.66 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -46.73 -51.84 15.28 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.731 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.914 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 55.6 m -59.31 -43.45 92.65 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -58.08 4.16 0.02 OUTLIER 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.583 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.645 ' O ' ' N ' ' A' ' 30' ' ' LYS . 6.7 tp -164.8 -124.99 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.075 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 36.88 -81.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.73 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.645 ' N ' ' O ' ' A' ' 28' ' ' LEU . 2.2 mptp? -92.78 14.92 15.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.936 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.582 ' N ' ' O ' ' A' ' 28' ' ' LEU . 22.3 m170 62.97 49.71 3.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.862 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.914 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -90.37 -173.29 3.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.83 0.348 . . . . 0.0 110.586 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -114.3 -31.77 6.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.828 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.9 p -165.99 -168.11 1.2 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.41 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . 160.68 175.22 31.45 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.353 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -176.77 176.38 1.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 111.007 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.0 m -88.27 136.92 32.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.856 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -143.19 131.22 21.75 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.843 0.354 . . . . 0.0 111.664 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.571 ' CZ ' HD22 ' A' ' 45' ' ' LEU . 10.2 m-85 -72.42 166.82 21.82 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.476 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.405 ' OD1' ' N ' ' A' ' 44' ' ' ASN . 1.3 p30 -139.99 179.27 6.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.99 -14.78 51.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.49 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.95 5.98 49.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.988 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 18.6 ttp180 62.65 53.72 2.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.722 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.405 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 10.0 m-80 -143.95 135.55 26.04 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.962 ' H ' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -92.1 104.85 17.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.09 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 137.86 32.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.561 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 21.1 m -82.53 104.51 12.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.105 0.478 . . . . 0.0 110.884 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.41 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 17.1 mt -87.03 124.4 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.779 -178.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -98.37 113.84 25.96 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.944 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 53' ' ' GLU . 8.8 t70 -93.45 154.93 17.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.013 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.6 -33.4 2.54 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.15 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -142.39 0.58 1.32 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.293 -179.269 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.588 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 9.6 pm0 35.36 34.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.01 0.433 . . . . 0.0 110.607 -179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.453 ' O ' ' O ' ' A' ' 53' ' ' GLU . 4.4 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.856 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 120.771 0.32 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.74 65.91 1.88 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.153 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.2 mtpt -65.17 -139.71 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.862 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.429 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 2.1 m -145.85 0.0 0.83 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.583 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -93.68 133.22 37.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.554 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.16 127.34 13.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 111.074 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.4 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.8 OUTLIER -66.58 146.04 13.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.9 OUTLIER -70.51 90.53 0.74 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.62 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -62.29 74.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.241 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.62 ' ND2' ' O ' ' A' ' 9' ' ' GLU . 20.2 p30 125.15 118.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.728 1.211 . . . . 0.0 109.968 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 42.1 t80 178.56 140.22 0.26 Allowed Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.318 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.7 73.66 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.145 1.897 . . . . 0.0 112.43 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.42 ' H ' HG23 ' A' ' 13' ' ' VAL . 3.0 t -55.38 99.75 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.874 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.0 p -175.89 -66.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.914 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -65.57 -3.92 5.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.967 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.42 83.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.107 0.48 . . . . 0.0 110.631 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.652 ' H ' HD12 ' A' ' 18' ' ' LEU . 40.1 mt-30 -145.87 22.78 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.296 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.887 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -164.42 129.73 2.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.076 0.465 . . . . 0.0 110.447 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.27 74.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.905 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.607 ' O ' ' N ' ' A' ' 23' ' ' ASN . 12.5 t-20 -162.39 -113.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.526 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.556 ' C ' ' O ' ' A' ' 20' ' ' ASN . 2.2 mp0 -3.18 -78.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.719 0.637 . . . . 0.0 112.098 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.6 t -58.89 -54.35 48.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 110.786 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' ASN . 60.3 t30 -52.17 -64.85 0.68 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.232 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.479 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.54 -41.9 61.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.257 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.441 ' OD1' ' O ' ' A' ' 21' ' ' GLN . 1.5 m-20 -54.39 -71.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.13 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.458 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -51.97 -32.18 32.32 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.248 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -59.57 0.2 0.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.396 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.458 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.8 tt -164.93 -26.72 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.717 0.294 . . . . 0.0 111.667 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -69.37 -52.59 25.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 110.822 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.88 11.72 34.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.492 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.8 m170 62.11 33.22 17.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.886 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.2 -179.79 6.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -29.59 13.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 110.398 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.5 p -179.13 -169.94 0.16 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.141 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 169.13 179.77 41.33 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.334 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -175.68 153.62 1.45 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -88.67 137.06 32.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.838 0.352 . . . . 0.0 111.212 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -147.56 152.45 37.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.45 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -57.08 -173.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.855 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 26.4 p-10 -170.75 85.07 0.1 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 40' ' ' ASP . 4.8 pt-20 30.56 27.8 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.821 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 1.5 mtpt -148.59 6.11 0.72 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.727 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 66.55 -2.82 0.97 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.128 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 42' ' ' LYS . 7.8 m-80 -95.42 140.34 30.43 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.718 ' N ' HD12 ' A' ' 45' ' ' LEU . 2.3 mp -78.97 155.42 28.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.666 0.745 . . . . 0.0 112.778 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.433 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -142.95 132.95 24.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.105 179.2 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.7 m -75.52 98.57 3.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.512 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.8 mp -86.66 107.39 16.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.36 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.3 m -97.97 119.19 36.15 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.819 0.343 . . . . 0.0 111.278 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -93.86 129.91 40.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -95.59 -32.65 12.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.054 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -143.62 -84.79 0.15 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.499 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 16.8 tt0 146.7 -14.29 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.497 0.498 . . . . 0.0 110.488 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.454 ' C ' ' O ' ' A' ' 53' ' ' GLU . 3.5 m-30 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.93 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.618 0 CA-C-O 120.891 0.377 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.65 -60.62 2.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.021 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.4 mtmm -123.83 126.48 46.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.929 0.395 . . . . 0.0 110.891 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -91.56 8.41 36.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.186 -179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.481 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -144.51 158.26 43.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.424 179.688 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.48 119.29 6.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.042 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.68 HG23 ' H ' ' A' ' 9' ' ' GLU . 2.9 m -63.29 139.22 21.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.905 0.383 . . . . 0.0 110.985 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.544 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 28.5 t80 -51.06 -5.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.808 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.68 ' H ' HG23 ' A' ' 7' ' ' VAL . 28.0 mt-10 91.15 6.79 0.07 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.368 0.667 . . . . 0.0 111.39 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.583 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 52.5 t-20 113.47 74.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.1 0.875 . . . . 0.0 111.669 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 22' ' ' CYS . 4.1 t80 -54.11 144.05 40.76 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.532 ' O ' ' C ' ' A' ' 13' ' ' VAL . 19.7 Cg_endo -60.13 40.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.194 1.929 . . . . 0.0 112.678 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 11' ' ' TYR . 76.9 t 8.15 81.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 123.325 0.65 . . . . 0.0 112.598 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.5 p -175.77 20.8 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -172.05 101.74 0.17 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.163 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.8 OUTLIER -170.95 1.77 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.55 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.499 ' O ' HD12 ' A' ' 18' ' ' LEU . 19.3 mt-30 -78.16 50.95 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.064 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.639 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 2.2 mp -165.22 -114.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.773 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.639 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 165.67 46.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 0.0 110.703 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 21' ' ' GLN . 21.4 t30 -137.9 -63.62 0.56 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.49 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 24.4 tp60 -39.83 -72.23 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.866 0.365 . . . . 0.0 110.601 -179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 5.1 m -62.68 -45.18 93.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -50.34 -67.31 0.27 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.579 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.529 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.83 -50.82 55.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -43.39 -57.27 3.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.903 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 76.1 m -58.55 -45.33 89.15 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -57.05 0.48 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.508 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.794 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.1 tp -165.54 -131.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.501 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 35.3 -68.69 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 123.675 0.609 . . . . 0.0 112.481 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.794 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -87.47 -5.43 58.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.983 0.42 . . . . 0.0 110.098 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.547 ' N ' ' O ' ' A' ' 28' ' ' LEU . 1.6 m170 79.17 36.3 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.039 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.903 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.89 -179.69 5.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.578 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 53.0 mtt-85 -99.55 -28.75 13.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.228 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.5 p -175.95 -159.67 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.519 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.92 -176.16 41.38 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.936 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -176.34 158.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.819 0.342 . . . . 0.0 110.495 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.6 m -88.88 147.91 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.215 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -139.3 132.24 29.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.747 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.496 ' CE2' HD12 ' A' ' 45' ' ' LEU . 48.7 m-85 -89.78 139.21 30.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.91 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.599 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -93.48 76.42 4.44 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.096 0.474 . . . . 0.0 110.783 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' A' ' 40' ' ' ASP . 2.3 pt-20 19.02 44.94 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.631 -1.168 . . . . 0.0 112.114 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.9 mtpm? -142.3 -65.83 0.4 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.554 ' CG ' ' O ' ' A' ' 42' ' ' LYS . 2.3 mmm180 167.79 -21.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.915 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -87.98 172.35 9.63 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.772 HD13 ' N ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -149.53 168.97 22.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.497 0.665 . . . . 0.0 112.527 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -135.92 141.57 44.54 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.346 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 90.3 m -92.6 103.43 15.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.108 -179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 57.7 mt -84.54 120.17 34.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.614 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.1 m -92.76 116.1 28.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -90.76 120.77 32.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.244 0.545 . . . . 0.0 111.121 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.578 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 66.5 m-85 -97.81 13.62 29.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.654 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 54' ' ' TYR . 73.0 m -142.64 -102.38 0.13 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.913 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 48.62 -91.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.864 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.435 ' N ' ' O ' ' A' ' 52' ' ' CYS . 84.6 m-85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.922 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 120.679 0.275 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.514 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 3.1 p30 -142.18 42.36 1.66 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.077 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.2 mmtm -79.3 121.78 25.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.69 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -94.6 8.83 40.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.382 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.26 134.26 19.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.808 0.337 . . . . 0.0 110.674 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.97 131.8 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.443 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -64.55 141.57 18.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -44.52 -85.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.512 ' O ' ' N ' ' A' ' 11' ' ' TYR . 2.0 mt-10 -178.07 -155.3 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.702 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.56 ' O ' ' C ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -39.17 -25.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.562 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.684 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 2.3 t80 1.67 91.68 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.86 0.725 . . . . 0.0 111.685 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.519 ' O ' ' C ' ' A' ' 13' ' ' VAL . 60.6 Cg_endo -74.14 59.16 4.45 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 121.836 1.69 . . . . 0.0 112.269 -179.246 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.756 HG22 ' N ' ' A' ' 14' ' ' SER . 7.3 p 6.83 -119.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.452 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.756 ' N ' HG22 ' A' ' 13' ' ' VAL . 1.4 p 84.83 -2.78 0.93 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.039 0.447 . . . . 0.0 110.06 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.436 ' CG ' ' C ' ' A' ' 14' ' ' SER . 2.4 mttt -164.41 108.7 0.95 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.327 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -172.67 97.7 0.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.046 0.451 . . . . 0.0 111.142 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.483 ' CG ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mt-30 -172.71 23.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.304 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.82 146.33 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.525 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.26 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.133 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.58 ' O ' ' N ' ' A' ' 23' ' ' ASN . 66.3 t30 -173.8 -132.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.061 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.529 ' C ' ' O ' ' A' ' 20' ' ' ASN . 13.4 mm-40 8.32 -87.43 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.979 0.8 . . . . 0.0 112.379 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 39.6 m -53.46 -56.68 14.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.955 0.407 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.58 ' N ' ' O ' ' A' ' 20' ' ' ASN . 2.5 t30 -52.46 -64.79 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.488 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -51.91 -50.97 60.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.135 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' A' ' 29' ' ' ASP . 67.8 m-20 -51.39 -60.27 3.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.889 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.445 ' C ' ' H ' ' A' ' 28' ' ' LEU . 66.9 m -54.51 -41.38 69.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.037 0.446 . . . . 0.0 110.169 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.516 ' HA ' ' HZ3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -59.48 3.75 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.17 -179.608 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.9 tt -163.27 -36.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.285 -0.566 . . . . 0.0 112.324 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 25' ' ' ASP . 85.4 m-20 -68.07 -44.07 77.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.801 0.334 . . . . 0.0 110.662 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.6 10.73 26.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m80 42.37 48.21 4.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.059 0.457 . . . . 0.0 110.008 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.582 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -85.97 -177.69 6.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.655 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.597 ' NE ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -101.67 -30.11 11.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.046 0.45 . . . . 0.0 110.343 179.851 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.584 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.2 OUTLIER -172.99 155.19 3.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.278 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.484 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 165.04 175.17 35.51 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.547 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 38' ' ' PHE . 10.8 pt-20 -178.2 -162.64 0.06 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.781 0.324 . . . . 0.0 110.734 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -87.06 129.22 35.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.279 179.475 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 36' ' ' GLU . 34.7 m-85 -147.05 167.07 24.98 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.334 0.587 . . . . 0.0 111.857 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.695 ' CE1' HD13 ' A' ' 45' ' ' LEU . 65.0 m-85 -98.17 -117.59 0.14 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.801 178.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.526 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.1 OUTLIER 51.4 149.55 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.42 0.629 . . . . 0.0 112.014 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.471 ' CG ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 89.41 -56.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.474 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.473 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 1.9 ttmt -149.63 30.61 0.74 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 54.72 18.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.995 0.426 . . . . 0.0 110.311 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.473 ' OD1' ' O ' ' A' ' 42' ' ' LYS . 6.6 m-20 -95.75 125.5 40.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.697 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.695 HD13 ' CE1' ' A' ' 39' ' ' TYR . 6.6 tp -85.78 112.4 21.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.813 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -142.22 161.32 38.31 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 112.23 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.684 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 73.0 m -75.62 96.66 3.6 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.873 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.3 mt -90.27 117.17 33.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.358 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 59.7 m -93.48 110.53 22.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.038 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' SER . 0.9 OUTLIER -93.1 160.67 14.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.786 0.803 . . . . 0.0 112.265 -178.993 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 4' ' ' CYS . 87.4 m-85 -128.35 -28.41 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.209 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m -98.58 -3.09 37.04 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.749 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 74.71 -83.93 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.128 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.047 -179.851 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 120.794 0.33 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 50.74 -172.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.652 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.505 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 3.3 mmtt -97.55 125.62 42.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.705 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.505 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.1 m 165.86 23.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.172 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.85 154.87 43.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.726 0.298 . . . . 0.0 110.765 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -151.12 121.14 7.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.293 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -63.06 116.35 2.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.564 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -55.52 76.45 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.129 -179.476 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 7' ' ' VAL . 50.5 mt-10 8.81 117.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.511 ' C ' ' O ' ' A' ' 9' ' ' GLU . 6.0 m-20 14.47 52.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.613 ' O ' ' N ' ' A' ' 13' ' ' VAL . 87.4 t80 -54.6 136.61 62.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.414 ' HD2' ' CD1' ' A' ' 11' ' ' TYR . 76.6 Cg_exo -40.43 84.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 121.852 1.701 . . . . 0.0 111.768 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -56.61 106.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.53 -179.061 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 89.2 p -175.75 -86.55 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.06 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.785 ' CB ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -69.59 159.28 33.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.949 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.581 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.0 m -170.58 -79.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.678 0.275 . . . . 0.0 111.393 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' LEU . 2.4 mp0 63.08 13.22 6.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.151 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.62 HD12 ' N ' ' A' ' 18' ' ' LEU . 4.4 mp 28.38 57.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.325 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 173.86 35.53 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.03 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.574 ' O ' ' N ' ' A' ' 23' ' ' ASN . 50.3 t30 -174.5 -118.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.785 HE21 ' CB ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -1.01 -83.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.997 0.811 . . . . 0.0 112.209 179.534 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 0.3 OUTLIER -58.57 -50.78 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.256 -179.755 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 20' ' ' ASN . 10.2 t-20 -51.55 -69.04 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.931 0.396 . . . . 0.0 110.51 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.47 -47.12 66.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.935 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 29' ' ' ASP . 94.9 m-20 -56.9 -67.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.602 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 28' ' ' LEU . 4.3 m -50.42 -40.52 50.46 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.227 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -58.91 5.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.665 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.649 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.2 tm? -163.46 -40.92 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.878 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 25' ' ' ASP . 32.4 m-20 -68.21 -53.07 27.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.746 0.307 . . . . 0.0 111.298 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -99.74 18.63 17.68 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.904 0.383 . . . . 0.0 111.097 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 41.46 35.65 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.886 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.502 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.44 -171.91 3.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.16 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -95.17 -48.0 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.825 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.476 ' O ' ' OD2' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -163.48 145.8 9.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.076 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.4 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -114.91 178.21 17.79 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.895 -0.669 . . . . 0.0 113.314 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.4 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 4.8 mt-10 -174.66 139.98 0.57 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -88.78 145.28 25.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 0.0 110.896 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -144.04 142.16 30.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.929 0.395 . . . . 0.0 110.718 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.535 ' CE2' HD21 ' A' ' 45' ' ' LEU . 63.2 m-85 -72.21 -177.7 2.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.866 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.589 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.3 OUTLIER 163.35 -172.2 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.419 0.628 . . . . 0.0 111.195 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.8 OUTLIER 24.95 -82.23 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.143 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.604 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 26.2 mmtt -134.26 79.29 1.8 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.831 0.348 . . . . 0.0 111.645 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 46.65 28.38 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.121 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.604 ' OD1' ' N ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -94.44 122.83 37.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.622 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.535 HD21 ' CE2' ' A' ' 39' ' ' TYR . 12.1 mt -89.08 109.11 20.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.685 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -93.22 135.84 34.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.657 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.487 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.3 m -77.21 100.97 5.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -86.78 116.73 29.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.556 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 99.2 m -93.76 111.47 23.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.865 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.502 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -88.0 143.32 27.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.524 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -112.46 -3.9 14.34 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.86 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.9 m -140.04 -118.25 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.741 0.305 . . . . 0.0 110.761 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 179.03 19.57 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.022 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.946 -179.465 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.65 0 CA-C-O 120.888 0.375 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.443 ' O ' ' CB ' ' A' ' 3' ' ' LYS . 1.0 OUTLIER -72.21 -101.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.333 179.638 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.581 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER 161.46 83.87 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.766 179.667 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.581 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.3 m 160.05 37.81 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.657 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -146.01 139.17 25.92 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.032 0.444 . . . . 0.0 111.55 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.432 ' NZ ' ' OH ' ' A' ' 51' ' ' TYR . 25.8 pttt -151.77 140.72 21.08 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.754 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.66 HG12 ' NE2' ' A' ' 46' ' ' GLN . 0.8 OUTLIER -59.98 154.94 3.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 121.22 0.533 . . . . 0.0 111.818 -178.975 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.714 ' CE2' ' CZ ' ' A' ' 11' ' ' TYR . 57.1 t80 -91.05 -16.77 27.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.602 -178.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.53 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 22.48 110.97 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.367 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 11' ' ' TYR . 1.4 t-20 170.27 -71.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 177.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.714 ' CZ ' ' CE2' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -46.72 173.54 0.04 OUTLIER Pre-proline 0 C--O 1.231 0.087 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.708 179.73 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.74 ' O ' HG12 ' A' ' 13' ' ' VAL . 16.7 Cg_exo -66.05 -14.84 46.28 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.358 1.372 . . . . 0.0 110.189 178.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.74 HG12 ' O ' ' A' ' 12' ' ' PRO . 1.9 p 103.94 -20.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.224 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.78 -33.67 75.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.682 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -69.19 147.26 51.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 110.57 179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.47 ' SG ' HD22 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -175.55 -75.74 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 -179.887 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 49.56 29.91 3.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.2 0.524 . . . . 0.0 110.072 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.3 mt 44.69 -133.45 0.75 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.408 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.23 80.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.562 ' O ' ' N ' ' A' ' 22' ' ' CYS . 50.5 t30 -176.83 -117.14 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.902 0.382 . . . . 0.0 111.69 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.591 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 1.5 tp-100 -57.73 54.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 112.277 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.591 ' SG ' ' O ' ' A' ' 21' ' ' GLN . 1.7 m 177.8 -58.79 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 -59.19 -52.0 67.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -48.9 78.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.879 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.499 ' OD1' ' N ' ' A' ' 22' ' ' CYS . 3.7 m-20 -52.8 -53.91 41.63 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.348 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 28' ' ' LEU . 71.7 m -53.39 -46.62 69.75 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 13.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.511 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 26' ' ' CYS . 52.7 tp -165.27 -36.37 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.415 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -68.62 -44.43 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.623 0.249 . . . . 0.0 111.021 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.471 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 42.2 mmtt -107.79 -0.16 21.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.195 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.471 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 75.78 35.7 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -87.13 177.39 7.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.213 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -107.43 -5.37 17.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.577 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.406 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER 174.39 -169.26 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.365 -179.815 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -173.65 -165.03 29.8 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.636 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.502 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 2.0 mt-10 -176.44 -164.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 110.366 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.4 m -144.17 132.35 21.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.628 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.788 ' CD2' HD12 ' A' ' 48' ' ' ILE . 97.8 m-85 -146.62 169.86 18.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.071 0.462 . . . . 0.0 111.531 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.614 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.0 m-85 -100.84 120.15 39.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.639 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.681 ' O ' ' N ' ' A' ' 42' ' ' LYS . 5.3 p-10 -122.65 123.38 41.02 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 40' ' ' ASP . 15.2 tt0 21.74 35.17 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.855 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.681 ' N ' ' O ' ' A' ' 40' ' ' ASP . 19.4 mtmm -147.1 -6.24 0.5 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.687 0.279 . . . . 0.0 111.34 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 31.6 mmt-85 57.56 10.08 0.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.008 0.432 . . . . 0.0 110.049 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 10.2 m-20 -94.73 -130.91 0.15 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.303 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.682 ' O ' HG22 ' A' ' 13' ' ' VAL . 2.3 mt -152.95 95.17 1.94 Allowed 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.66 ' NE2' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -89.7 156.1 18.77 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 178.702 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 13.3 m -106.65 115.18 29.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.062 0.458 . . . . 0.0 111.292 -178.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.788 HD12 ' CD2' ' A' ' 38' ' ' PHE . 23.0 mt -88.93 132.29 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.727 -178.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 92.1 m -100.38 112.47 24.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.005 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.471 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.4 OUTLIER -94.24 140.51 29.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.203 0.525 . . . . 0.0 111.302 -179.473 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.432 ' OH ' ' NZ ' ' A' ' 6' ' ' LYS . 71.7 m-85 -113.46 -24.91 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.167 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -145.16 64.04 1.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.174 -179.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -86.15 31.98 0.63 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.832 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.192 -0.908 . . . . 0.0 110.927 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.579 0 CA-C-O 120.814 0.34 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' A' ' 3' ' ' LYS . 2.9 m-20 -144.41 143.6 31.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.741 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 2' ' ' ASP . 5.0 mttp -38.66 106.42 0.05 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.83 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -179.65 21.59 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.992 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -118.11 134.14 55.27 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.858 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -149.22 125.49 10.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.998 0.428 . . . . 0.0 111.27 179.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.33 144.27 14.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.434 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.51 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.5 t80 -84.68 61.89 7.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.926 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.637 ' O ' ' N ' ' A' ' 11' ' ' TYR . 4.1 mm-40 32.94 -159.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.625 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -58.73 44.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.207 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.637 ' N ' ' O ' ' A' ' 9' ' ' GLU . 7.0 t80 -52.92 134.41 48.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.552 ' C ' ' H ' ' A' ' 14' ' ' SER . 84.6 Cg_exo -39.32 85.54 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.156 1.904 . . . . 0.0 112.475 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' TYR . 9.6 p -57.48 1.3 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.401 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.552 ' H ' ' C ' ' A' ' 12' ' ' PRO . 35.7 p -62.94 -95.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.286 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.66 113.79 5.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.007 0.432 . . . . 0.0 111.447 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -175.06 108.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.205 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -143.24 -23.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.674 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.13 -178.94 4.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 110.961 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.43 112.1 1.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.57 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.558 ' ND2' ' OE1' ' A' ' 21' ' ' GLN . 49.3 t-20 -175.55 -105.66 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.782 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.558 ' OE1' ' ND2' ' A' ' 20' ' ' ASN . 9.6 mm100 -50.05 -55.89 12.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.851 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.7 t -55.7 -57.38 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.26 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -51.45 -64.88 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.874 0.368 . . . . 0.0 110.625 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.552 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.69 -47.03 64.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.326 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.555 ' O ' ' N ' ' A' ' 29' ' ' ASP . 20.1 m-20 -52.12 -64.71 0.73 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.5 ' C ' ' H ' ' A' ' 28' ' ' LEU . 89.9 m -51.32 -50.32 59.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -61.87 14.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.712 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.3 tm? -163.73 -41.01 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.265 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.555 ' N ' ' O ' ' A' ' 25' ' ' ASP . 3.5 m-20 -67.43 -47.61 69.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.1 mtpm? -101.25 6.53 42.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.829 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 58.15 36.66 26.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.535 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.75 -174.77 5.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.038 0.447 . . . . 0.0 111.467 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.4 tpt85 -93.87 -25.96 17.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.7 p -176.35 -164.11 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.287 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 159.83 176.02 31.45 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.792 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -177.0 164.43 2.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 0.0 110.437 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 136.82 33.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.872 0.368 . . . . 0.0 110.519 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -146.73 162.16 39.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 23.0 m-85 -86.07 175.95 8.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.03 0.443 . . . . 0.0 111.462 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.595 ' C ' ' H ' ' A' ' 42' ' ' LYS . 17.9 p-10 -109.41 173.21 6.42 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.322 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' OE1' ' N ' ' A' ' 41' ' ' GLU . 53.0 mp0 -65.14 27.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.673 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.595 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 -74.15 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.571 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.467 ' O ' ' CG ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER 169.71 70.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.387 179.631 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 35.1 m120 -141.61 -155.42 0.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.428 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.55 137.05 21.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.807 0.337 . . . . 0.0 110.608 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -146.97 139.69 25.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.586 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -82.65 100.2 10.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.318 179.517 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.2 mm -82.89 112.58 20.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.556 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.7 m -95.76 117.51 30.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.227 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.505 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.1 OUTLIER -95.01 143.65 26.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.929 0.395 . . . . 0.0 110.727 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -114.23 -26.67 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.611 -179.062 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.482 ' O ' ' O ' ' A' ' 53' ' ' GLU . 62.2 m -95.06 -111.15 0.13 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.743 0.306 . . . . 0.0 110.887 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.487 ' O ' ' OE1' ' A' ' 53' ' ' GLU . 1.0 OUTLIER 49.66 107.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.884 -179.942 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.861 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.551 0 CA-C-O 120.755 0.312 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.42 ' O ' ' C ' ' A' ' 3' ' ' LYS . 5.3 t0 -165.51 -39.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 2' ' ' ASP . 12.2 ttmt -37.0 133.19 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.751 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 15.2 m -94.94 5.83 50.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.047 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.61 153.35 40.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.763 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -149.71 128.92 12.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.116 0.484 . . . . 0.0 111.638 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.409 HG12 HD11 ' A' ' 48' ' ' ILE . 5.6 m -64.34 146.3 13.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.615 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.75 76.96 7.15 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.559 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.5 pt-20 -61.58 82.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.416 -178.563 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 1.3 t-20 153.73 -2.82 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.286 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.639 ' CE1' ' SG ' ' A' ' 47' ' ' CYS . 3.9 t80 -55.83 129.43 71.64 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.632 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.535 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.4 Cg_exo -59.77 45.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 121.91 1.74 . . . . 0.0 113.256 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 11' ' ' TYR . 36.0 t 2.97 93.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 123.705 0.628 . . . . 0.0 112.665 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.504 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 85.1 p -171.22 -97.41 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.154 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.504 ' N ' ' OG ' ' A' ' 14' ' ' SER . 18.0 tttp -63.93 117.11 6.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.95 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -172.0 -12.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.019 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.41 ' H ' ' HG2' ' A' ' 17' ' ' GLN . 14.8 mm-40 -80.39 33.18 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.597 0.237 . . . . 0.0 110.79 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.4 ' H ' ' C ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -166.96 116.97 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.724 -179.672 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.77 99.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.654 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.9 t-20 -168.82 -86.78 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -45.55 -61.0 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.306 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.574 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.6 t -58.16 -54.46 46.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.43 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.593 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -51.03 -63.4 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.728 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.497 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.44 -47.94 62.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.243 179.312 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 29' ' ' ASP . 14.6 m-20 -50.81 -62.6 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.506 ' C ' ' H ' ' A' ' 28' ' ' LEU . 80.4 m -53.85 -41.4 67.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -59.99 7.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.063 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.506 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -162.36 -40.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.045 -179.375 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.506 ' N ' ' O ' ' A' ' 25' ' ' ASP . 71.8 m-20 -67.35 -54.28 21.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.767 0.318 . . . . 0.0 111.004 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 1.3 mmmm -102.25 29.9 4.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.888 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 7.9 m170 33.09 39.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.427 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.671 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -89.01 -176.11 5.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.678 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -95.92 -26.12 15.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.07 0.462 . . . . 0.0 110.458 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.451 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -175.17 -159.14 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.07 -179.972 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.593 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . 164.72 -172.0 40.32 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.978 -1.106 . . . . 0.0 113.456 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 4.9 tt0 -177.07 -144.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.914 0.388 . . . . 0.0 110.521 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.09 133.84 17.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.648 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -149.66 -177.96 6.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.222 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -90.31 -166.79 1.67 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.863 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.471 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -176.41 -173.07 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.612 -179.755 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -60.52 -2.57 0.52 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.399 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.528 ' C ' ' H ' ' A' ' 44' ' ' ASN . 6.0 mmtp -100.81 -1.43 34.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.086 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 59.47 -2.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.243 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.528 ' H ' ' C ' ' A' ' 42' ' ' LYS . 2.1 m120 -94.97 158.81 15.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.695 0.283 . . . . 0.0 110.749 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mt -87.84 133.2 33.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -146.5 157.2 43.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.187 0.518 . . . . 0.0 111.363 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.639 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -70.77 157.33 38.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.121 -179.72 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.409 HD11 HG12 ' A' ' 7' ' ' VAL . 0.9 OUTLIER -143.43 111.85 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.953 -179.819 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.8 m -92.22 119.0 31.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.887 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.671 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 1.7 t70 -92.7 158.39 15.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.441 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -129.92 -36.11 1.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 34.5 m -97.54 -113.39 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.918 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 54' ' ' TYR . 76.5 mm-40 -131.31 -118.62 0.22 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.628 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.47 ' O ' ' O ' ' A' ' 53' ' ' GLU . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.022 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PCA . . . . . 0.403 ' O ' ' CB ' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.447 -0.625 0 CA-C-O 120.861 0.362 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.403 ' CB ' ' O ' ' A' ' 1' ' ' PCA . 9.2 t0 75.49 -1.22 3.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.565 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -110.64 -5.1 15.11 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.944 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.8 m -157.77 50.28 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.378 . . . . 0.0 110.986 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 138.4 26.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.939 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.556 ' C ' HG12 ' A' ' 7' ' ' VAL . 3.6 mtpm? -147.84 -156.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.128 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.556 HG12 ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -168.52 158.84 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.627 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.13 114.31 22.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.034 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -65.42 4.91 0.47 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.412 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.627 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 9.3 p30 178.23 136.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.727 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.6 t80 -179.42 100.92 0.19 Allowed Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.928 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.642 ' O ' ' N ' ' A' ' 14' ' ' SER . 80.7 Cg_exo -45.39 65.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.885 2.39 . . . . 0.0 113.624 -178.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.727 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.4 t 8.98 51.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 123.967 0.907 . . . . 0.0 113.297 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.642 ' N ' ' O ' ' A' ' 12' ' ' PRO . 2.8 p -68.7 135.64 51.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 0.0 111.915 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 26.66 32.37 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.579 ' N ' ' O ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -71.52 82.05 0.81 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.469 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -161.53 -42.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.977 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -73.06 -103.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.501 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.52 22.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.506 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.591 ' O ' ' N ' ' A' ' 22' ' ' CYS . 18.5 t-20 -114.59 -112.16 0.34 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.021 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.563 ' C ' ' O ' ' A' ' 20' ' ' ASN . 11.6 mm-40 0.89 -68.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.775 0.672 . . . . 0.0 111.827 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 42.7 t -60.94 -68.15 0.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.694 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.5 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.5 OUTLIER -47.17 -46.96 23.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.226 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.05 -48.97 78.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.096 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -52.37 -57.0 11.2 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.393 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.648 ' C ' ' H ' ' A' ' 28' ' ' LEU . 91.6 m -58.13 -44.05 87.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -61.43 11.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.54 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.699 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.2 tp -160.89 -134.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.071 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 40.41 -76.87 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.175 0.297 . . . . 0.0 111.77 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 28' ' ' LEU . 9.9 mmtp -90.6 -9.16 48.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 110.557 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.455 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 3.3 m170 79.91 49.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.206 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.642 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.92 -136.57 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.157 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -141.45 -53.63 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.665 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -155.92 133.34 10.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.641 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.45 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . -105.98 -157.19 22.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.5 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -172.14 131.54 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 87.2 m -90.36 123.3 33.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.724 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.442 ' CE1' HG13 ' A' ' 48' ' ' ILE . 23.2 p90 -149.16 140.7 23.39 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 120.513 -0.475 . . . . 0.0 112.017 -179.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.51 ' HA ' ' H ' ' A' ' 45' ' ' LEU . 59.5 m-85 -72.69 133.87 44.8 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.66 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 42' ' ' LYS . 13.1 p-10 -146.68 -166.13 2.41 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.458 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.488 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.4 tt0 22.23 42.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.186 -178.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.58 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.2 mtpt 68.96 83.05 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.207 178.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.4 ttp85 61.54 52.73 3.56 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.002 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.427 ' ND2' ' HB3' ' A' ' 41' ' ' GLU . 3.3 m-20 -93.34 -60.31 1.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.51 ' H ' ' HA ' ' A' ' 39' ' ' TYR . 11.9 tp 76.92 67.19 0.05 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.296 -178.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -91.87 -175.96 4.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.015 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -127.27 123.56 36.74 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.534 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -87.58 155.05 3.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.499 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.3 m -135.28 108.7 7.85 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.039 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -94.29 134.77 36.42 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -101.36 -24.67 14.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.93 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.476 ' O ' ' OE2' ' A' ' 53' ' ' GLU . 4.1 m -139.98 -116.89 0.13 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.019 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.476 ' OE2' ' O ' ' A' ' 52' ' ' CYS . 0.1 OUTLIER 157.6 -107.52 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.046 0.451 . . . . 0.0 110.656 179.425 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.459 ' H ' ' CG ' ' A' ' 53' ' ' GLU . 95.3 m-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.999 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 CA-C-O 120.954 0.407 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -148.81 153.05 37.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.587 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -104.67 113.18 26.59 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.144 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.6 m -96.25 -0.48 49.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.346 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.466 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -118.38 126.89 53.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.914 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.45 138.03 47.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.069 0.462 . . . . 0.0 111.787 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.739 HG23 ' H ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -61.41 146.98 11.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.62 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.609 ' CG ' ' O ' ' A' ' 8' ' ' TYR . 2.2 t80 -92.11 42.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.962 0.41 . . . . 0.0 110.429 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.739 ' H ' HG23 ' A' ' 7' ' ' VAL . 4.5 pt-20 17.83 76.96 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.031 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.543 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 7.3 m120 103.74 145.41 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.059 0.849 . . . . 0.0 110.827 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 13' ' ' VAL . 39.4 t80 -179.32 123.7 0.24 Allowed Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.421 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_exo -41.75 82.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.293 1.995 . . . . 0.0 112.733 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.575 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.1 t -55.21 95.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 p -175.26 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -26.3 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.101 0.477 . . . . 0.0 110.123 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.449 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -68.09 90.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.735 179.236 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.654 ' H ' HD12 ' A' ' 18' ' ' LEU . 30.2 mt-30 -158.29 21.4 0.24 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.652 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.916 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -165.69 -79.55 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.739 0.304 . . . . 0.0 111.044 -179.588 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -178.01 -159.83 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 -178.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.497 ' O ' ' N ' ' A' ' 24' ' ' TYR . 28.9 t-20 60.83 -72.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.381 -179.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.545 ' N ' ' O ' ' A' ' 19' ' ' ALA . 6.0 mm-40 -39.49 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.6 t -59.57 -46.41 88.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.704 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -54.25 -76.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.234 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.497 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.58 -43.33 35.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.467 179.926 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 29' ' ' ASP . 46.0 m-20 -50.37 -60.54 2.89 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.542 ' C ' ' H ' ' A' ' 28' ' ' LEU . 81.9 m -55.97 -39.53 71.94 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.275 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -59.69 7.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.836 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.542 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.8 tt -163.35 -26.07 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.638 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 25' ' ' ASP . 17.8 m-20 -70.03 -51.81 29.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 110.649 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 3.7 mmmm -110.21 0.24 18.1 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.969 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.402 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.2 OUTLIER 66.75 41.53 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.429 -179.594 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.535 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -85.83 -178.61 6.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.365 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -95.65 -10.57 29.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.071 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.4 ' OG ' ' OE1' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 174.67 -169.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.987 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.71 170.24 37.61 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.835 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.04 153.19 0.78 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -88.43 137.16 32.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.569 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -146.4 159.99 42.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -69.65 -168.64 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.612 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -161.64 156.69 23.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.461 0.648 . . . . 0.0 112.67 -179.782 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 40' ' ' ASP . 5.1 mm-40 11.73 -69.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.378 -1.283 . . . . 0.0 114.137 179.03 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -88.75 -57.1 3.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.388 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER 164.25 31.44 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.903 0.382 . . . . 0.0 110.02 -179.738 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -94.68 135.77 35.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.594 179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.586 HD13 ' N ' ' A' ' 46' ' ' GLN . 1.9 tm? -86.43 131.93 34.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.179 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.586 ' N ' HD13 ' A' ' 45' ' ' LEU . 38.1 mt-30 -142.25 165.47 27.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.543 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.458 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -97.19 103.69 15.65 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.413 -179.494 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.558 ' N ' HD13 ' A' ' 48' ' ' ILE . 1.9 mm -93.69 119.81 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.1 m -94.49 123.37 37.87 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.208 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.566 ' OD1' ' N ' ' A' ' 53' ' ' GLU . 15.1 t70 -94.67 136.9 34.44 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.179 0.514 . . . . 0.0 111.373 -179.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -110.68 -9.61 14.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.56 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 3.7 m -135.23 -43.76 0.71 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.566 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 13.1 tp10 82.56 -64.1 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.046 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.558 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 120.84 0.352 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.5 t70 42.79 36.92 0.92 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.98 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -169.68 167.36 9.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.487 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 62.9 m -146.02 -3.65 0.66 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.412 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.15 118.95 37.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.451 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -149.82 115.8 5.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.053 0.454 . . . . 0.0 112.103 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.431 HG12 HG12 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -70.69 148.0 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 178.745 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.667 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -103.96 -7.44 20.37 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.027 179.58 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 8' ' ' TYR . 2.0 tm-20 30.23 104.82 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.105 -0.952 . . . . 0.0 112.095 -178.248 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.667 ' ND2' ' O ' ' A' ' 8' ' ' TYR . 3.0 p30 170.5 -44.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.264 179.003 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.478 ' CE2' ' OD2' ' A' ' 25' ' ' ASP . 55.0 t80 -53.62 139.37 49.98 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.737 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 14' ' ' SER . 94.5 Cg_exo -39.59 95.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.081 1.854 . . . . 0.0 112.058 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.2 p -53.02 -7.17 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 12' ' ' PRO . 96.9 p -65.25 -88.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.082 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.472 ' N ' ' OG ' ' A' ' 14' ' ' SER . 35.8 tptt -66.02 139.65 58.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.756 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.75 22.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.915 0.388 . . . . 0.0 110.974 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -113.77 57.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.185 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.593 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -168.88 124.99 0.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.96 54.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.552 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.593 ' N ' ' O ' ' A' ' 18' ' ' LEU . 11.3 t30 -159.82 -73.81 0.07 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.442 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.581 ' O ' ' CB ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -53.05 90.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.969 179.299 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.581 ' CB ' ' O ' ' A' ' 21' ' ' GLN . 52.3 t 120.61 -57.95 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.613 1.196 . . . . 0.0 109.878 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 0.1 OUTLIER -56.5 -54.7 42.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.031 0.443 . . . . 0.0 109.854 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.519 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -55.18 -48.2 74.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.185 179.147 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.595 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -53.09 -51.27 62.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.069 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.819 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 22.2 m -56.27 -44.31 79.64 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.6 tttp -60.76 12.27 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.132 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.648 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -162.16 -129.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.664 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.576 ' H ' HD12 ' A' ' 28' ' ' LEU . 0.4 OUTLIER 40.05 -81.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.706 0.289 . . . . 0.0 111.292 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.648 ' N ' ' O ' ' A' ' 28' ' ' LEU . 18.0 mttm -95.3 5.25 52.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.5 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.563 ' N ' ' O ' ' A' ' 28' ' ' LEU . 3.3 m170 71.94 56.47 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.819 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.58 177.53 6.52 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.494 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -96.78 -21.83 17.31 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.094 0.473 . . . . 0.0 109.864 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.494 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 1.5 p 158.59 137.86 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.049 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.439 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -128.67 -173.17 13.36 Favored Glycine 0 CA--C 1.51 -0.221 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.398 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -179.0 158.95 0.96 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 0.0 110.531 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.8 m -87.17 138.51 31.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.579 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -138.24 157.48 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.876 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.628 ' CE1' HD21 ' A' ' 45' ' ' LEU . 68.1 m-85 -93.22 -169.76 2.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.794 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.554 ' C ' ' H ' ' A' ' 42' ' ' LYS . 30.2 p30 -166.58 -172.3 2.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -65.04 18.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.827 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.554 ' H ' ' C ' ' A' ' 40' ' ' ASP . 12.3 mmtp -138.25 17.89 2.78 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.929 0.395 . . . . 0.0 111.043 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.11 13.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.463 179.214 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.404 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 91.2 m-20 -94.67 141.33 28.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.808 0.337 . . . . 0.0 111.166 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.628 HD21 ' CE1' ' A' ' 39' ' ' TYR . 16.7 mt -87.78 147.35 25.21 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.943 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.404 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 2.5 mp0 -147.05 134.49 20.8 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.29 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . 1.5 m -77.42 102.19 6.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.435 0.636 . . . . 0.0 112.391 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.431 HG12 HG12 ' A' ' 7' ' ' VAL . 5.0 mt -89.28 117.34 32.44 Favored 'Isoleucine or valine' 0 C--N 1.341 0.208 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.077 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.2 m -93.97 115.61 27.98 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 110.101 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.465 ' OD2' ' O ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.05 129.24 44.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.447 0.642 . . . . 0.0 110.597 179.754 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -102.38 -12.41 17.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.001 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.8 m -145.78 83.57 1.65 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.051 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.444 ' O ' ' O ' ' A' ' 54' ' ' TYR . 3.3 tt0 -164.07 72.67 0.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.844 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' GLU . 34.9 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.871 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.644 0 CA-C-O 120.661 0.267 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.14 155.0 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.852 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.12 17.03 10.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.624 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.2 m -157.96 13.72 0.21 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.32 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.9 pttt -146.26 131.47 18.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.852 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -145.44 124.94 13.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.409 . . . . 0.0 111.088 -179.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.04 129.28 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.43 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.97 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.604 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 176.13 -173.43 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.556 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.723 ' O ' ' O ' ' A' ' 11' ' ' TYR . 4.3 p30 -19.51 -42.13 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.968 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.723 ' O ' ' O ' ' A' ' 10' ' ' ASN . 59.1 t80 20.15 131.11 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.588 ' C ' ' H ' ' A' ' 14' ' ' SER . 49.0 Cg_endo -67.62 102.35 0.72 Allowed 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.98 1.787 . . . . 0.0 112.624 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.517 ' O ' HG12 ' A' ' 13' ' ' VAL . 9.3 t -59.83 10.83 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.767 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.588 ' H ' ' C ' ' A' ' 12' ' ' PRO . 95.7 p -61.0 -5.58 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.599 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -166.78 127.85 1.65 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.016 0.436 . . . . 0.0 111.211 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 60.9 m -166.42 11.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.76 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.4 8.13 41.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.518 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.645 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -159.51 136.98 9.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.21 0.528 . . . . 0.0 110.495 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.734 ' HB1' HD22 ' A' ' 23' ' ' ASN . . . -59.41 113.85 2.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.667 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.519 ' O ' ' C ' ' A' ' 21' ' ' GLN . 56.6 t-20 -175.83 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.844 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.519 ' C ' ' O ' ' A' ' 20' ' ' ASN . 72.0 tp60 -16.34 -74.37 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.92 0.763 . . . . 0.0 112.009 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.3 t -57.98 -49.25 77.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.734 HD22 ' HB1' ' A' ' 19' ' ' ALA . 44.8 t-20 -53.8 -69.56 0.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.144 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -38.96 32.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.562 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 29' ' ' ASP . 13.9 m-20 -55.45 -63.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.394 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.47 ' C ' ' H ' ' A' ' 28' ' ' LEU . 16.4 m -56.38 -38.95 72.15 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.57 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.196 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.647 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.3 tm? -163.24 -41.17 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.5 -0.48 . . . . 0.0 112.046 -179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.551 ' N ' ' O ' ' A' ' 25' ' ' ASP . 96.6 m-20 -68.26 -16.44 63.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 110.895 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -143.33 22.69 1.85 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.237 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 40.74 39.58 0.8 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.11 0.481 . . . . 0.0 111.131 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.37 -173.79 4.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.846 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.55 -40.74 9.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.229 0.537 . . . . 0.0 110.494 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -161.28 175.46 12.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.686 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -158.77 146.58 13.33 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.408 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -175.73 156.52 1.86 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.419 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 2.8 m -88.38 145.19 25.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.432 0.634 . . . . 0.0 112.553 -178.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -143.3 163.37 33.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.437 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.4 166.75 22.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.707 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.487 ' O ' ' C ' ' A' ' 41' ' ' GLU . 2.1 p30 -171.53 176.11 3.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.635 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.487 ' C ' ' O ' ' A' ' 40' ' ' ASP . 69.7 mm-40 15.42 -90.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.687 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 mtpt -99.68 63.8 1.25 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.734 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 40.41 50.18 2.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.374 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.28 121.25 42.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.553 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.77 86.65 7.35 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -99.36 144.36 28.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.226 -178.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.672 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -63.02 101.42 0.27 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.322 179.601 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mt -92.59 120.79 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.108 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.4 m -92.47 116.3 28.87 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.26 139.65 30.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.245 0.545 . . . . 0.0 111.281 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -109.42 -22.47 12.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.296 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.541 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -146.73 -59.44 0.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.318 . . . . 0.0 111.27 -179.439 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.541 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 8.7 tt0 90.25 -78.95 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.693 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.803 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.628 0 CA-C-O 120.757 0.313 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 t70 44.28 85.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.558 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm 60.49 -168.27 0.17 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.656 -179.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.4 m -156.24 -40.91 0.08 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.168 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.911 0.386 . . . . 0.0 111.513 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.55 ' C ' HG12 ' A' ' 7' ' ' VAL . 38.8 mttt -144.99 -164.46 1.93 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.301 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.55 HG12 ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -167.69 157.16 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.432 . . . . 0.0 110.971 -179.42 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.604 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.86 107.78 17.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.991 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.49 4.88 0.33 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.604 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 4.9 p30 172.96 123.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.987 0.423 . . . . 0.0 110.701 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.558 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER 178.66 156.79 0.6 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.439 -179.843 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.404 ' C ' ' O ' ' A' ' 11' ' ' TYR . 41.5 Cg_exo -30.11 84.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 123.31 2.674 . . . . 0.0 112.939 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.558 ' N ' ' O ' ' A' ' 11' ' ' TYR . 8.8 t -57.2 -36.74 52.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.546 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.33 -49.96 73.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.028 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -64.48 99.13 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.964 0.411 . . . . 0.0 110.388 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -172.08 110.64 0.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.286 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.495 ' O ' ' O ' ' A' ' 18' ' ' LEU . 75.7 mt-30 -137.36 52.85 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.651 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 20.8 mt 32.87 97.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.98 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 99.99 146.48 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 O-C-N 123.679 0.612 . . . . 0.0 111.422 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 22' ' ' CYS . 11.8 t-20 63.66 -79.3 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.671 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.53 39.99 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.586 ' N ' ' O ' ' A' ' 20' ' ' ASN . 9.9 t -179.58 -52.82 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.457 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.441 ' OD1' ' C ' ' A' ' 23' ' ' ASN . 10.8 t-20 -58.26 -54.24 49.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.146 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.523 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -57.39 -44.36 84.43 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.71 178.868 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 29' ' ' ASP . 0.1 OUTLIER -54.3 -58.64 6.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.521 179.729 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.55 ' C ' ' H ' ' A' ' 28' ' ' LEU . 85.1 m -55.11 -42.1 72.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -62.28 12.26 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.697 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.55 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.2 tp -162.86 -44.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.631 -179.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.641 ' N ' ' O ' ' A' ' 25' ' ' ASP . 94.1 m-20 -68.34 -17.41 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.056 0.455 . . . . 0.0 110.496 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.429 ' NZ ' ' O ' ' A' ' 7' ' ' VAL . 41.8 mttt -140.24 3.63 1.97 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.05 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.4 m170 53.23 35.9 21.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.965 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.657 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.46 -167.76 1.99 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -97.17 -44.75 6.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.023 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 84.0 p -157.69 -155.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.099 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 158.23 -171.53 35.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.448 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -175.98 162.61 2.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.933 0.397 . . . . 0.0 111.123 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 73.3 m -88.81 138.1 31.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.092 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -148.74 146.82 28.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.922 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.404 ' CE1' ' HG ' ' A' ' 45' ' ' LEU . 64.9 m-85 -86.36 160.64 19.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.6 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -93.33 -172.92 3.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.618 179.587 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -65.49 19.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.54 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.6 ' H ' ' C ' ' A' ' 40' ' ' ASP . 13.4 mtpp -140.93 -73.41 0.34 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.092 179.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.453 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 9.8 mtp85 153.45 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.644 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.47 ' O ' ' O ' ' A' ' 45' ' ' LEU . 0.7 OUTLIER -109.48 -0.25 18.95 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -178.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.47 ' O ' ' O ' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 57.3 136.77 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.752 0.311 . . . . 0.0 111.074 179.791 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -147.78 170.62 17.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.837 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.12 108.99 13.98 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.095 0.474 . . . . 0.0 111.515 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.9 mt -87.06 129.25 38.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.51 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.5 m -110.11 118.73 37.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.853 0.358 . . . . 0.0 111.187 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.657 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 4.8 t0 -96.55 152.95 18.15 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.794 179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 32' ' ' ALA . 13.8 m-85 -130.23 3.62 4.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.958 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.542 ' O ' ' O ' ' A' ' 53' ' ' GLU . 40.9 m -142.49 -110.83 0.13 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.423 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.542 ' O ' ' O ' ' A' ' 52' ' ' CYS . 6.6 mp0 20.75 107.06 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.503 0.502 . . . . 0.0 112.254 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.161 -0.924 . . . . 0.0 110.757 179.773 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.662 0 CA-C-O 120.836 0.35 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -76.26 -134.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.91 -179.912 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.43 ' C ' ' H ' ' A' ' 5' ' ' LYS . 14.3 mttp 66.21 126.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.061 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.16 15.34 0.33 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.729 179.923 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.457 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -141.11 113.99 8.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.435 179.828 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -98.54 125.36 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.189 -179.098 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.435 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -66.98 146.25 13.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.626 178.801 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.57 84.22 6.81 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.096 0.474 . . . . 0.0 109.8 179.246 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.585 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -67.08 113.91 5.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.687 179.839 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.585 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 23.3 t-20 117.17 -34.25 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 O-C-N 124.144 0.902 . . . . 0.0 110.698 179.835 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.577 ' O ' ' O ' ' A' ' 12' ' ' PRO . 38.2 t80 -41.25 140.32 1.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.241 -179.995 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.577 ' O ' ' O ' ' A' ' 11' ' ' TYR . 72.6 Cg_exo -48.22 -146.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.413 2.075 . . . . 0.0 113.408 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.56 HG22 ' C ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -169.99 74.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.449 -179.984 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.9 p -174.17 -64.93 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -67.72 97.28 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.256 179.103 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 0.8 OUTLIER -170.97 113.0 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.44 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mm-40 156.72 -48.85 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.897 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' C ' ' A' ' 19' ' ' ALA . 10.9 mt -71.16 52.86 0.17 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.004 -179.542 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.544 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 3.78 84.97 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.974 0.797 . . . . 0.0 112.26 179.313 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.485 ' O ' ' C ' ' A' ' 21' ' ' GLN . 36.7 t30 -164.18 -96.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.283 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.485 ' C ' ' O ' ' A' ' 20' ' ' ASN . 13.1 mm100 -28.88 -76.8 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.489 -179.514 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.2 t -48.12 -64.95 0.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.904 0.383 . . . . 0.0 111.616 -179.735 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.504 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 2.8 t30 -47.63 -70.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.681 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -50.61 -43.32 56.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.3 m-20 -51.77 -65.59 0.53 Allowed 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.509 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.41 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.5 m -52.8 -42.08 64.74 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.068 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.9 tttp -59.14 1.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.747 -179.698 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.41 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.0 tt -167.81 -44.8 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.732 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 14.3 m-20 -64.62 -2.19 2.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.944 0.402 . . . . 0.0 110.78 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.7 mttm -144.75 8.58 1.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.33 179.338 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 53.48 36.03 22.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.768 179.978 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.593 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -88.11 -178.21 5.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 111.451 -179.691 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.485 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -93.68 -31.32 14.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.465 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.1 p -176.72 -160.9 0.07 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.776 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.504 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 146.68 173.41 17.89 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.249 -0.977 . . . . 0.0 112.775 179.615 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.408 ' HG3' ' H ' ' A' ' 37' ' ' CYS . 0.4 OUTLIER -176.49 179.01 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.844 0.354 . . . . 0.0 110.652 179.964 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.408 ' H ' ' HG3' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -87.44 103.29 15.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.531 179.712 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -95.22 152.49 18.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.417 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.635 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 20.0 m-85 -96.5 -166.8 1.47 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.287 179.269 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.591 ' C ' ' H ' ' A' ' 42' ' ' LYS . 14.1 p-10 -133.68 -174.06 3.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.815 0.34 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.69 28.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.858 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -145.6 -81.76 0.15 Allowed 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.268 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.08 39.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.441 179.142 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.635 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 27.1 m-20 -90.17 -168.1 2.03 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.143 -179.315 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.49 HD21 ' CE1' ' A' ' 39' ' ' TYR . 7.7 mt -152.3 133.64 14.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 111.619 -179.552 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -148.51 137.81 21.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.114 179.065 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.09 96.2 6.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.96 0.41 . . . . 0.0 111.217 -179.351 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.72 114.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.713 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -93.14 115.06 27.72 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.935 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.593 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 7.4 t70 -87.92 142.94 27.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.969 0.414 . . . . 0.0 111.584 -178.932 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -118.01 -27.26 6.18 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.485 -179.663 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.98 86.5 1.86 Allowed 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.276 -179.358 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -69.91 47.85 0.09 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.493 179.407 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.619 ' O ' ' CD1' ' A' ' 54' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.473 -179.961 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.538 0 CA-C-O 120.911 0.386 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.488 ' O ' ' C ' ' A' ' 3' ' ' LYS . 2.2 m-20 -79.7 -167.65 1.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.83 -179.885 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.488 ' C ' ' O ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER -20.68 137.29 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.717 0.635 . . . . 0.0 111.936 -179.93 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.7 m -175.26 -22.02 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.886 179.97 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm -138.0 129.08 27.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -148.89 126.47 11.68 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.815 0.341 . . . . 0.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -63.22 158.28 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.338 179.055 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.463 ' O ' ' C ' ' A' ' 9' ' ' GLU . 23.5 t80 -82.64 -15.75 50.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.055 0.455 . . . . 0.0 111.433 -179.368 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.463 ' C ' ' O ' ' A' ' 8' ' ' TYR . 1.9 pt-20 26.57 78.8 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.724 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.417 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 3.7 m-20 165.1 -41.23 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.204 179.513 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -52.16 108.86 1.18 Allowed Pre-proline 0 CA--C 1.535 0.401 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.593 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.615 ' O ' ' N ' ' A' ' 14' ' ' SER . 94.2 Cg_endo -81.57 70.41 7.32 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.179 1.919 . . . . 0.0 112.299 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.577 HG13 HD23 ' A' ' 45' ' ' LEU . 2.6 t 18.85 44.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 123.85 0.719 . . . . 0.0 112.142 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.615 ' N ' ' O ' ' A' ' 12' ' ' PRO . 3.7 p -67.42 -7.58 26.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.512 -179.929 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.494 ' O ' ' C ' ' A' ' 16' ' ' CYS . 30.0 tptt -172.35 -88.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.381 -179.712 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.5 OUTLIER 26.37 97.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.397 -179.787 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -144.17 1.76 1.11 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.157 -179.933 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.456 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 10.7 mt -164.24 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.297 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 176.58 109.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.794 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -179.13 -82.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.336 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.452 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 3.3 tp60 -46.45 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.224 -179.414 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.28 -40.18 85.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.523 -179.57 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -53.23 -65.94 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.41 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.563 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -52.24 -42.2 63.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.033 178.882 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.9 m-20 -50.79 -60.73 2.75 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.815 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 28' ' ' LEU . 57.0 m -54.86 -49.9 70.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 178.379 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 17.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.869 179.503 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.517 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.5 tm? -165.47 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.018 -0.673 . . . . 0.0 112.262 -179.395 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.643 ' N ' ' O ' ' A' ' 25' ' ' ASP . 11.0 m-20 -67.77 -11.73 59.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.743 0.306 . . . . 0.0 111.16 -179.507 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 31' ' ' HIS . 24.9 mttm -139.14 27.21 2.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.849 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 34.71 38.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.287 0.565 . . . . 0.0 110.328 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.571 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -83.7 176.75 8.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.814 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.437 ' H ' ' HA ' ' A' ' 51' ' ' TYR . 31.3 ttm180 -92.81 -27.62 17.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 -179.967 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.8 p 177.96 -165.08 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.497 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.77 -176.88 47.58 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.476 -179.982 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -175.49 157.57 2.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.882 0.372 . . . . 0.0 110.962 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -90.7 104.38 16.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.603 -179.556 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -96.19 171.54 8.54 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.53 ' O ' ' O ' ' A' ' 40' ' ' ASP . 3.5 m-85 -99.11 -8.84 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.626 0.251 . . . . 0.0 111.039 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.53 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.4 OUTLIER 50.43 161.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.0 111.276 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -63.98 8.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.094 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -105.35 -23.72 12.8 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-O 120.9 0.381 . . . . 0.0 110.578 -179.982 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 66.29 52.2 1.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.665 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -139.24 12.22 2.59 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.825 0.345 . . . . 0.0 111.492 -179.641 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.577 HD23 HG13 ' A' ' 13' ' ' VAL . 4.7 tp 64.79 122.36 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.191 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -143.19 155.05 44.45 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.832 179.228 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 98.7 m -98.47 113.13 25.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.981 0.42 . . . . 0.0 112.016 -179.136 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -91.8 117.01 34.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.569 179.607 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.9 m -94.95 112.15 23.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.959 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.571 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 3.6 t70 -94.85 154.21 17.35 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.971 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.437 ' HA ' ' H ' ' A' ' 33' ' ' ARG . 66.7 m-85 -131.04 -22.34 2.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.438 -179.017 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.543 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -139.13 -64.64 0.5 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.724 0.297 . . . . 0.0 110.948 -179.439 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.543 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 9.4 tt0 88.17 -9.97 0.51 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.109 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.464 ' CD1' ' O ' ' A' ' 53' ' ' GLU . 46.3 m-85 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.978 179.988 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 CA-C-O 120.8 0.333 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.409 ' CG ' ' O ' ' A' ' 2' ' ' ASP . 14.5 p-10 -89.96 70.17 7.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.716 179.99 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.29 93.1 4.35 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.044 0.45 . . . . 0.0 111.213 -179.797 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.64 11.89 1.89 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.671 179.426 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -97.23 121.45 39.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.889 179.859 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.73 126.1 24.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.064 0.459 . . . . 0.0 111.144 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.5 m -62.36 149.52 9.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.014 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' O ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -51.01 -103.44 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.7 179.19 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.454 ' H ' ' HB3' ' A' ' 8' ' ' TYR . 0.7 OUTLIER 178.13 -14.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.378 -0.201 . . . . 0.0 111.484 179.445 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -178.01 21.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.326 . . . . 0.0 110.996 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.491 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 49.8 t80 -56.01 113.54 5.96 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.02 99.23 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.077 1.851 . . . . 0.0 112.256 179.926 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -53.7 92.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.39 179.759 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.556 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 0.6 OUTLIER -175.46 128.5 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.797 -179.702 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 14' ' ' SER . 2.9 tptt 92.62 -13.35 0.17 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.631 -179.82 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m -66.56 70.61 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.728 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' A' ' 15' ' ' LYS . 10.3 mp0 -114.43 -15.62 12.05 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.376 -179.734 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.587 ' N ' HD12 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -162.11 176.27 10.87 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.93 0.395 . . . . 0.0 110.349 -179.843 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -56.7 -149.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.639 -179.837 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 61.55 -79.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.262 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.491 ' OE1' ' OH ' ' A' ' 11' ' ' TYR . 7.8 tp-100 -41.18 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.153 -179.645 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 t -59.36 -41.89 90.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.22 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.21 -74.16 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.009 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.539 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -49.33 -40.12 34.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.529 179.92 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 7.7 m-20 -55.64 -65.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.137 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.456 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.9 m -56.33 -35.93 68.17 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.906 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttpp -59.86 2.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.93 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.456 ' H ' ' C ' ' A' ' 26' ' ' CYS . 13.2 tp -165.14 -36.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.0 m-20 -67.86 -14.17 62.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -141.38 16.9 2.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.756 179.677 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.4 m80 53.2 29.11 7.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.62 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.46 -175.61 5.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.634 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -98.41 -50.34 4.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 -179.82 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.0 OUTLIER -141.43 -173.58 3.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.323 179.595 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.457 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . -168.21 166.38 39.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.063 -1.065 . . . . 0.0 113.363 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -177.2 146.68 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.05 138.43 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.993 0.425 . . . . 0.0 111.527 -179.453 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.19 158.1 43.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.644 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.563 ' CE2' ' CD2' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -81.93 155.26 25.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.839 179.77 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.55 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 4.6 p-10 -161.5 58.62 0.28 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.832 0.348 . . . . 0.0 111.688 -179.885 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 19.1 tp10 93.34 -16.86 0.12 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.47 -0.787 . . . . 0.0 111.579 178.685 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.61 -7.53 34.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.234 -179.221 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? 40.11 39.87 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.236 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -143.64 5.58 1.4 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.563 ' CD2' ' CE2' ' A' ' 39' ' ' TYR . 1.0 OUTLIER 71.65 152.67 0.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.192 179.441 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -149.09 137.4 20.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.163 179.483 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 98.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 43.0 mm -89.82 113.29 25.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.2 m -92.36 129.84 38.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.079 0.466 . . . . 0.0 111.231 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -96.13 125.17 40.47 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.689 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -98.92 -27.44 13.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.752 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.8 m -101.03 -107.81 0.23 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.184 0.516 . . . . 0.0 110.867 179.741 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.551 ' CG ' ' H ' ' A' ' 54' ' ' TYR . 4.1 tp10 -168.3 -137.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.176 179.988 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.551 ' H ' ' CG ' ' A' ' 53' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.189 -0.91 . . . . 0.0 110.137 179.676 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.58 0 CA-C-O 120.829 0.347 . . . . 0.0 111.347 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.43 ' O ' ' C ' ' A' ' 3' ' ' LYS . 53.8 t0 -166.64 -61.03 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.746 179.838 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.575 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 30.5 mmtt -37.13 122.46 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.59 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.575 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.3 m 158.66 -3.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.035 -179.424 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -87.7 143.29 27.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.312 0.577 . . . . 0.0 112.037 -178.782 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -147.88 122.16 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.922 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.74 149.89 5.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.398 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.477 ' N ' ' O ' ' A' ' 47' ' ' CYS . 0.3 OUTLIER -105.86 76.65 1.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.875 -1.057 . . . . 0.0 108.305 177.719 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 11' ' ' TYR . 1.6 pt-20 -47.63 -94.0 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.689 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -47.18 92.76 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.377 178.877 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.496 ' N ' ' O ' ' A' ' 9' ' ' GLU . 67.1 t80 -177.8 107.29 0.22 Allowed Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.05 -179.099 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.589 ' O ' ' N ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.57 124.36 8.05 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.351 2.034 . . . . 0.0 112.276 179.925 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.662 ' O ' HG12 ' A' ' 13' ' ' VAL . 40.8 t -60.57 45.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.938 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.589 ' N ' ' O ' ' A' ' 12' ' ' PRO . 78.5 p -63.3 -125.86 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.476 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -68.64 151.91 46.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.335 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.464 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -173.27 -32.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.205 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -74.19 38.93 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.608 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 16' ' ' CYS . 27.4 mt -161.91 -102.58 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.828 -179.639 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -179.62 -153.69 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.415 -179.443 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.74 -82.49 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.417 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.457 ' C ' ' O ' ' A' ' 20' ' ' ASN . 2.9 tp60 -33.82 -76.46 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.475 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.91 -52.34 65.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.244 0.545 . . . . 0.0 110.661 179.242 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -78.25 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.32 -179.623 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -44.87 -48.98 11.15 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.832 -179.361 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.451 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 5.0 m-20 -52.88 -65.77 0.5 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.442 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.475 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -57.34 -29.9 64.37 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.52 -179.854 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.84 1.54 0.14 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.071 179.131 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.475 ' H ' ' C ' ' A' ' 26' ' ' CYS . 23.6 tp -162.44 -31.73 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.391 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -68.63 -17.56 64.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.202 0.525 . . . . 0.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -141.93 -1.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.54 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.3 m80 63.73 42.15 6.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.791 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.496 ' HB2' ' CE2' ' A' ' 51' ' ' TYR . . . -89.03 -173.62 4.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 8.1 ttp180 -98.99 -56.5 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.999 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 48.4 p -167.55 135.34 2.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.038 -179.931 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -123.28 -165.13 12.25 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.42 -0.895 . . . . 0.0 114.983 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -176.14 -145.77 0.02 OUTLIER 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.16 -1.02 . . . . 0.0 109.118 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.17 137.55 20.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.655 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.537 ' CD2' ' CD1' ' A' ' 48' ' ' ILE . 19.6 m-85 -142.21 157.07 45.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.304 178.968 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.532 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 17.2 m-85 -72.08 169.3 16.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.433 -179.582 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -162.9 -158.94 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.436 -179.488 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -62.88 -11.26 17.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.828 -179.36 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.591 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -94.62 10.15 35.96 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.084 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 52.33 2.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.983 0.421 . . . . 0.0 111.144 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.804 ' C ' HD23 ' A' ' 45' ' ' LEU . 49.4 m-20 -100.88 -136.04 0.31 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.619 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.804 HD23 ' C ' ' A' ' 44' ' ' ASN . 0.2 OUTLIER -152.39 118.47 5.5 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.317 0.579 . . . . 0.0 111.183 179.053 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -97.26 152.03 19.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.548 -179.601 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -78.18 113.38 16.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.665 179.617 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.537 ' CD1' ' CD2' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -101.31 113.0 36.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.739 -179.693 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.3 m -99.11 134.56 41.78 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.338 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.2 t70 -95.2 115.81 27.92 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.849 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.496 ' CE2' ' HB2' ' A' ' 32' ' ' ALA . 96.8 m-85 -103.43 57.0 0.74 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.648 -179.224 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.84 21.6 9.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.158 -179.531 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -77.11 4.04 11.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.149 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.741 179.9 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.53 0 CA-C-O 120.822 0.344 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -177.86 -159.66 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.808 -179.807 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.1 mttt 71.15 150.98 0.1 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.948 0.404 . . . . 0.0 111.294 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m 51.34 48.59 22.7 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.24 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.05 155.99 43.16 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.791 179.275 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -151.01 110.24 3.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.017 0.437 . . . . 0.0 111.198 -179.698 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.411 HG13 ' H ' ' A' ' 7' ' ' VAL . 1.6 m -66.45 144.84 14.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.239 179.876 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.553 ' O ' ' CG ' ' A' ' 9' ' ' GLU . 1.9 t80 -63.13 -75.52 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.484 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.58 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.3 pp20? 104.26 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 O-C-N 124.649 1.218 . . . . 0.0 112.074 178.466 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.58 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 10.4 t-20 107.89 -12.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.346 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -52.92 113.49 4.65 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.847 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -42.73 112.48 0.27 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.014 1.81 . . . . 0.0 112.101 179.812 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.507 ' O ' ' C ' ' A' ' 14' ' ' SER . 69.4 t -52.7 -70.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.507 ' C ' ' O ' ' A' ' 13' ' ' VAL . 20.6 p 21.28 -95.04 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.669 179.974 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -69.82 108.95 4.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.477 179.667 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.27 57.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -141.54 22.46 2.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.82 179.943 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -167.81 125.87 1.21 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.53 179.947 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.24 99.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.627 -179.785 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -175.98 -68.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.603 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -47.99 -74.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.873 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.8 t -58.52 -40.52 83.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.181 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -53.49 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 -179.674 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.554 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.37 -45.39 62.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.344 179.998 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -64.48 0.8 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.835 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.446 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.2 m -54.45 -33.61 59.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -61.89 3.37 0.16 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.591 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.446 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.9 OUTLIER -164.35 -27.26 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.531 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -70.02 -29.67 66.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.789 0.328 . . . . 0.0 110.993 -179.899 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 31' ' ' HIS . 1.8 mtmp? -141.66 40.88 1.71 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.957 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.448 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.4 m80 31.73 44.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.363 179.864 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.12 179.27 6.17 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.92 0.39 . . . . 0.0 111.244 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.416 ' HG3' HH11 ' A' ' 33' ' ' ARG . 34.9 ttm-85 -96.15 -20.31 18.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.984 179.406 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.0 p 177.84 -176.24 0.18 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.241 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.6 167.87 36.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.796 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -177.24 157.21 1.32 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.805 0.336 . . . . 0.0 110.44 179.766 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -89.53 106.16 18.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.43 -179.369 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.454 ' HB2' HD12 ' A' ' 48' ' ' ILE . 30.0 m-85 -107.96 151.28 26.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.897 179.811 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.401 ' CE2' HD22 ' A' ' 45' ' ' LEU . 8.1 m-85 -81.13 177.17 9.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.935 0.398 . . . . 0.0 111.592 -179.76 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 42' ' ' LYS . 1.4 p30 -167.94 95.24 0.42 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.01 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' A' ' 40' ' ' ASP . 14.4 tt0 27.02 32.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.263 -179.908 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.641 ' N ' ' O ' ' A' ' 40' ' ' ASP . 16.9 mtpp -147.19 0.76 0.72 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.24 179.815 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 61.89 0.98 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.022 0.439 . . . . 0.0 110.283 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.59 ' ND2' ' O ' ' A' ' 42' ' ' LYS . 1.9 m120 -92.94 133.35 36.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.152 179.456 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.421 ' H ' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -86.44 117.49 25.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.569 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -100.63 141.45 33.48 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.086 178.653 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.88 94.26 1.41 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.96 0.409 . . . . 0.0 111.42 -179.682 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.454 HD12 ' HB2' ' A' ' 38' ' ' PHE . 5.8 mt -90.13 120.32 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.562 179.58 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.4 m -92.75 114.97 27.68 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 178.927 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.69 135.49 33.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.978 0.418 . . . . 0.0 111.246 -179.254 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.408 ' OH ' ' O ' ' A' ' 30' ' ' LYS . 10.7 m-85 -109.66 -21.84 12.23 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.047 -178.891 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.517 ' O ' ' N ' ' A' ' 54' ' ' TYR . 2.4 m -140.27 -34.58 0.53 Allowed 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.828 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.59 ' O ' ' CD2' ' A' ' 54' ' ' TYR . 2.5 pt-20 34.44 -94.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.915 0.388 . . . . 0.0 110.281 -178.848 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.59 ' CD2' ' O ' ' A' ' 53' ' ' GLU . 7.9 m-85 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.68 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 CA-C-O 120.79 0.329 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -132.74 -122.31 0.19 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.593 179.962 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.448 ' C ' ' H ' ' A' ' 5' ' ' LYS . 18.4 mtmt 60.34 80.39 0.21 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.436 179.828 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER 67.01 -34.62 0.23 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.245 179.076 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.448 ' H ' ' C ' ' A' ' 3' ' ' LYS . 17.9 pttm -96.48 132.86 41.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.16 0.505 . . . . 0.0 111.906 -179.227 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -146.83 134.79 21.41 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.76 179.908 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.478 ' O ' ' OE2' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -65.2 154.75 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.441 -179.919 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.475 ' OH ' ' OD2' ' A' ' 29' ' ' ASP . 1.0 OUTLIER -92.68 85.06 5.13 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.397 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.544 ' O ' ' C ' ' A' ' 10' ' ' ASN . 1.0 OUTLIER -58.1 171.6 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 -178.917 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.544 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 16.02 101.09 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.599 0.562 . . . . 0.0 111.568 -179.389 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.5 OUTLIER 175.91 141.13 0.21 Allowed Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.037 -178.92 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -34.03 80.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.948 2.432 . . . . 0.0 113.07 -179.604 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.62 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.8 p -60.23 -27.06 38.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.448 179.841 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.42 -45.93 90.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.329 -179.39 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.42 82.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.04 0.448 . . . . 0.0 110.614 -179.782 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -173.64 95.08 0.1 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 179.867 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -120.43 -34.15 3.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.933 179.552 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.458 HD23 ' HA ' ' A' ' 18' ' ' LEU . 7.0 mt -164.69 -175.21 3.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.304 179.852 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.559 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -53.82 177.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.376 -179.963 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 19' ' ' ALA . 7.9 t-20 96.93 -85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.778 179.697 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -50.82 -70.04 0.1 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.699 0.285 . . . . 0.0 111.66 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.558 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.3 t -53.93 -45.15 71.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.17 -179.481 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -55.47 -66.9 0.34 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.061 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.55 -47.44 57.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.817 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.454 ' O ' ' C ' ' A' ' 28' ' ' LEU . 2.2 m-20 -52.67 -51.11 61.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.555 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.643 ' C ' ' H ' ' A' ' 28' ' ' LEU . 87.4 m -57.88 -40.79 81.07 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.585 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -57.46 -0.45 0.06 Allowed 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 177.574 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.711 ' O ' ' N ' ' A' ' 30' ' ' LYS . 10.1 tp -162.96 -139.39 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.202 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.475 ' OD2' ' OH ' ' A' ' 8' ' ' TYR . 3.7 m-20 65.24 -50.39 0.36 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 -177.16 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.711 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -126.06 -85.97 0.62 Allowed 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.389 175.772 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.519 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.9 OUTLIER 169.13 54.16 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.41 178.053 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.05 179.73 6.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.799 179.468 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.28 -33.46 12.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.184 0.516 . . . . 0.0 110.482 -179.991 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.421 ' OG ' ' CD ' ' A' ' 53' ' ' GLU . 13.6 p -166.42 -162.57 0.53 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.569 -0.742 . . . . 0.0 109.811 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 177.72 -168.58 40.16 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 119.693 -1.242 . . . . 0.0 113.471 179.847 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.558 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.7 OUTLIER -177.06 -158.54 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -179.921 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.32 144.79 26.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 111.508 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.449 ' O ' ' N ' ' A' ' 46' ' ' GLN . 57.5 m-85 -144.77 159.97 42.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.198 -179.705 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.596 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 3.1 m-85 -84.44 173.97 10.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.683 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -153.85 -171.4 3.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.929 0.395 . . . . 0.0 111.133 -179.769 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -12.93 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.533 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' ' C ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -95.04 25.88 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.887 -179.912 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 29.55 55.2 0.13 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.192 179.566 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 75.6 m-20 -141.8 -125.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.704 179.701 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.543 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -148.78 162.43 39.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.318 . . . . 0.0 110.592 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 38' ' ' PHE . 83.5 mt-30 -148.3 114.57 5.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.704 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -68.52 102.95 1.56 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.453 -179.513 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.6 mm -89.09 114.89 27.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.06 179.304 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.8 m -98.0 119.21 36.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.988 0.423 . . . . 0.0 110.894 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.13 130.02 44.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.176 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -95.56 -21.67 18.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.963 -179.613 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.495 ' O ' ' N ' ' A' ' 54' ' ' TYR . 16.6 m -97.4 -78.65 0.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.947 -179.752 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.421 ' CD ' ' OG ' ' A' ' 34' ' ' SER . 34.7 tt0 59.0 -77.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.866 -179.806 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 52' ' ' CYS . 44.0 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.799 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 120.824 0.345 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.474 ' O ' ' O ' ' A' ' 3' ' ' LYS . 3.0 p-10 -130.2 -169.76 2.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.89 -179.973 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.474 ' O ' ' O ' ' A' ' 2' ' ' ASP . 32.8 mttp -51.71 -107.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.648 179.842 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m -172.85 -1.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.934 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.34 148.73 40.17 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.915 0.388 . . . . 0.0 110.355 179.71 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -150.36 125.56 10.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.881 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -65.58 150.13 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-O 120.837 0.351 . . . . 0.0 111.063 179.768 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.503 ' O ' ' O ' ' A' ' 9' ' ' GLU . 30.2 t80 -100.19 -10.92 20.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.214 0.531 . . . . 0.0 110.888 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.563 ' O ' ' C ' ' A' ' 10' ' ' ASN . 2.0 pm0 34.31 -158.04 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.64 -179.576 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.563 ' C ' ' O ' ' A' ' 9' ' ' GLU . 37.2 t-20 2.42 102.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.671 0.607 . . . . 0.0 111.863 -179.719 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.3 OUTLIER 179.97 141.13 0.32 Allowed Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.561 -179.197 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -40.03 90.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.232 1.955 . . . . 0.0 112.409 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.639 ' O ' ' N ' ' A' ' 15' ' ' LYS . 54.7 t -52.87 -90.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.361 179.863 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.496 ' C ' ' O ' ' A' ' 13' ' ' VAL . 60.7 p 9.96 -70.21 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.864 0.728 . . . . 0.0 112.866 179.206 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -60.28 89.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.997 -179.546 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 116.92 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.356 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -114.15 -54.16 2.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.569 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.447 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 1.4 mt -174.2 -20.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.918 179.467 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.447 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 178.7 104.24 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.631 -179.693 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -175.64 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.163 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.439 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 30.7 mm100 -50.71 -52.05 43.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.802 -179.772 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.65 -59.29 5.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 179.987 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -49.8 -63.68 1.04 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.57 -179.833 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -48.7 69.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.312 179.564 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 29' ' ' ASP . 23.7 m-20 -49.24 -65.14 0.62 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.5 179.816 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 28' ' ' LEU . 62.7 m -49.93 -41.99 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.326 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -61.0 10.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.659 179.169 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 26' ' ' CYS . 11.3 tp -163.14 -30.1 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.684 0.278 . . . . 0.0 111.711 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -70.0 -61.35 1.81 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.345 179.776 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.84 19.17 14.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 53.2 32.94 14.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 -179.31 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.601 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -84.28 -177.35 6.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.784 -179.431 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.0 -42.06 8.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.767 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.3 p -154.85 -156.44 0.67 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.842 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 171.2 -175.91 44.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.569 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -177.78 155.82 1.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.998 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.459 ' SG ' ' O ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -87.43 155.48 20.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.876 0.369 . . . . 0.0 110.899 179.99 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -146.65 121.13 9.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.808 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.662 ' CE1' HD21 ' A' ' 45' ' ' LEU . 34.8 m-85 -70.87 -93.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.245 179.555 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.54 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER 53.94 147.65 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.499 0.666 . . . . 0.0 111.694 179.409 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.54 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 2.6 tt0 89.62 -79.22 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.728 178.299 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.63 73.65 1.19 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.201 -178.792 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.58 38.78 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.296 179.314 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.634 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 17.5 m120 -92.77 -163.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.132 179.76 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.662 HD21 ' CE1' ' A' ' 39' ' ' TYR . 9.2 mt -155.23 98.22 1.98 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.786 0.327 . . . . 0.0 111.266 179.984 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.459 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 78.1 mt-30 -94.79 170.51 9.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.018 179.148 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.8 109.46 15.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.042 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mm -92.68 121.62 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.55 179.367 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.93 122.58 43.07 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.647 0.26 . . . . 0.0 110.63 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.601 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.1 OUTLIER -93.85 141.63 28.29 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.91 0.386 . . . . 0.0 110.63 -179.996 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -114.75 -12.83 12.1 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.907 -179.102 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -137.21 4.94 2.73 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.624 0.25 . . . . 0.0 111.374 -179.388 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.454 ' O ' ' C ' ' A' ' 54' ' ' TYR . 4.9 tt0 40.38 66.55 0.6 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.056 0.455 . . . . 0.0 110.653 179.913 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.454 ' C ' ' O ' ' A' ' 53' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.691 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 120.845 0.355 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -46.93 -57.45 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.148 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 mttm -91.25 153.28 20.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.47 -179.586 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER 173.4 -75.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.962 179.388 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -95.42 135.92 36.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 113.83 7.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.998 0.427 . . . . 0.0 111.331 -179.434 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.445 HG13 ' H ' ' A' ' 7' ' ' VAL . 0.8 OUTLIER -65.3 135.93 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.458 179.228 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.531 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -64.82 106.61 1.25 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.902 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 10' ' ' ASN . 8.5 mt-10 -63.06 43.16 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.324 -178.785 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 8' ' ' TYR . 14.4 m-20 172.42 -97.75 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.561 179.878 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.519 ' C ' ' O ' ' A' ' 10' ' ' ASN . 8.2 t80 8.52 76.37 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.423 0 O-C-N 123.733 0.645 . . . . 0.0 112.63 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.542 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.6 Cg_exo -62.66 109.66 0.94 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.985 2.457 . . . . 0.0 112.026 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.555 ' O ' ' CB ' ' A' ' 14' ' ' SER . 21.6 t 8.75 -108.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 O-C-N 123.845 0.716 . . . . 0.0 112.039 179.946 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 13' ' ' VAL . 5.1 p 91.33 -45.15 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.754 0.312 . . . . 0.0 111.457 179.124 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -172.56 74.94 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.977 0.418 . . . . 0.0 110.874 -178.972 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -66.44 -59.9 3.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.893 -179.689 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.596 ' O ' ' N ' ' A' ' 19' ' ' ALA . 0.9 OUTLIER 61.5 10.81 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.738 179.207 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.482 HD12 ' N ' ' A' ' 18' ' ' LEU . 6.5 mp 30.79 30.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' A' ' 17' ' ' GLN . . . 175.99 35.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.732 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 22' ' ' CYS . 8.6 t-20 -166.47 -141.29 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.518 179.537 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.548 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.6 OUTLIER 2.62 -69.37 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 124.008 0.817 . . . . 0.0 111.981 179.721 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.586 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.1 t -58.94 -65.71 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.023 179.57 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' ASN . 44.4 t-20 -51.29 -54.81 22.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.958 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -54.33 -44.63 72.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.137 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 78.6 m-20 -57.28 -64.79 0.77 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.219 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.479 ' C ' ' H ' ' A' ' 28' ' ' LEU . 58.1 m -52.78 -51.46 60.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.742 179.846 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -59.72 10.55 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.816 -179.799 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.479 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.82 -52.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 119.998 -0.681 . . . . 0.0 112.72 -179.495 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.5 OUTLIER -66.72 -7.57 21.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.578 0.228 . . . . 0.0 111.474 -179.12 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.409 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -141.81 24.84 2.01 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.952 0.406 . . . . 0.0 110.378 179.448 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.7 m80 38.46 38.91 0.27 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.037 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.16 -176.35 5.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.827 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -95.85 -45.27 7.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.384 179.825 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.474 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 2.7 p -168.93 130.96 1.24 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.92 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -101.98 174.88 24.71 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.33 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -174.92 138.31 0.46 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.982 0.42 . . . . 0.0 110.583 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.2 m -89.48 113.12 24.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.416 -179.453 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.623 ' CD1' HD12 ' A' ' 48' ' ' ILE . 18.7 m-85 -97.98 141.54 30.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.423 179.297 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.494 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 9.5 m-85 -83.26 -169.67 2.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.936 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.562 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 2.9 p-10 -173.59 156.03 2.87 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.346 0.593 . . . . 0.0 112.04 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.464 ' C ' ' O ' ' A' ' 40' ' ' ASP . 21.9 mt-10 16.92 -82.27 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.103 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.9 mptt -91.64 60.87 4.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.232 0.539 . . . . 0.0 110.943 -178.917 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.467 ' C ' ' O ' ' A' ' 42' ' ' LYS . 28.3 mmt180 29.04 60.44 0.14 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.584 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.689 ' C ' HD12 ' A' ' 45' ' ' LEU . 0.6 OUTLIER -95.39 -154.53 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.792 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.689 HD12 ' C ' ' A' ' 44' ' ' ASN . 5.7 mp -155.23 140.73 17.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.844 0.354 . . . . 0.0 110.995 179.545 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -143.05 131.81 22.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.252 179.834 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.66 101.73 4.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.358 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.623 HD12 ' CD1' ' A' ' 38' ' ' PHE . 15.7 mt -95.84 114.31 32.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.474 178.194 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.409 ' SG ' ' NZ ' ' A' ' 30' ' ' LYS . 91.7 m -94.73 118.8 32.32 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.301 179.364 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.1 t0 -94.45 118.3 31.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.452 0.644 . . . . 0.0 111.212 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -99.21 -89.65 0.31 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.029 179.6 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.4 m 62.45 26.22 15.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.032 179.53 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -125.07 -0.12 7.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.473 179.569 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.196 -0.906 . . . . 0.0 110.896 179.819 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.554 0 CA-C-O 120.897 0.38 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -69.41 50.08 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.952 179.953 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.9 mmtt -84.7 125.3 32.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.844 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.01 -12.22 60.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.752 179.934 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.92 97.01 3.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.411 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.4 mttt -93.72 107.22 19.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.897 0.38 . . . . 0.0 111.36 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.42 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.1 m -66.55 130.7 32.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.719 179.873 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.546 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -74.27 58.58 0.73 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.069 0.461 . . . . 0.0 110.442 179.504 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.567 ' O ' ' N ' ' A' ' 11' ' ' TYR . 7.1 mt-10 26.2 -153.61 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.442 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -60.16 56.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.611 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.567 ' N ' ' O ' ' A' ' 9' ' ' GLU . 42.8 t80 -50.69 140.97 18.41 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.414 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.409 ' HD2' ' CG ' ' A' ' 11' ' ' TYR . 17.0 Cg_endo -57.29 92.48 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 -179.68 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.0 t -53.88 105.88 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.185 -179.622 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 p -176.33 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.05 179.98 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.571 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 16.2 mmmt -66.02 136.39 55.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.108 179.169 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.571 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.5 m -170.11 -64.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.616 0.246 . . . . 0.0 111.492 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.477 ' C ' ' O ' ' A' ' 16' ' ' CYS . 1.7 mm-40 -28.14 -38.8 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.408 -179.478 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 16' ' ' CYS . 1.1 mp -70.65 -120.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.19 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.45 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -179.65 -20.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.248 0.547 . . . . 0.0 111.631 -179.736 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.479 ' O ' ' C ' ' A' ' 21' ' ' GLN . 35.6 t30 -47.62 -106.38 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.847 -178.93 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.479 ' C ' ' O ' ' A' ' 20' ' ' ASN . 11.2 mm100 -25.26 -60.22 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.309 -179.131 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -54.04 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.937 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 2.5 t-20 -48.73 -54.83 13.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.901 -179.324 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -52.29 -55.83 18.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.648 179.907 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 96.8 m-20 -50.74 -55.16 17.99 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.262 -179.619 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.0 m -54.85 -45.9 74.61 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.938 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -61.44 11.84 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.531 -0.758 . . . . 0.0 112.223 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.7 tt -165.02 -47.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.294 -0.562 . . . . 0.0 112.261 -179.469 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 92.4 m-20 -66.7 -11.27 53.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.133 0.492 . . . . 0.0 110.169 179.789 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.427 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 36.0 mmtm -141.72 5.37 1.77 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.038 179.427 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.427 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 41.17 46.05 2.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.737 -179.866 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.32 -173.7 4.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.917 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.12 -23.59 18.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.291 0.567 . . . . 0.0 109.698 179.541 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -177.64 -168.44 0.18 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.993 179.702 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.468 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . 166.95 170.26 31.6 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.929 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -179.31 -179.97 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.732 0.301 . . . . 0.0 110.259 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 39.1 m -88.61 88.82 7.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.266 179.391 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.524 ' HB2' HD12 ' A' ' 48' ' ' ILE . 42.9 m-85 -91.72 159.06 16.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.834 -179.734 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.565 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 5.0 m-85 -83.77 166.26 18.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.008 179.926 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.538 ' CG ' HE22 ' A' ' 46' ' ' GLN . 6.3 p-10 -129.19 -173.15 2.91 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.047 -179.532 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.52 2.06 0.19 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.29 -179.656 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -95.61 -63.89 1.11 Allowed 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.391 179.777 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.557 ' HB2' ' O ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 139.78 5.08 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.225 1.41 . . . . 0.0 109.734 179.397 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.917 ' O ' HD23 ' A' ' 45' ' ' LEU . 0.4 OUTLIER -90.96 -140.63 0.16 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.882 0.372 . . . . 0.0 111.302 -179.518 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.917 HD23 ' O ' ' A' ' 44' ' ' ASN . 0.2 OUTLIER -147.32 149.16 32.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 -179.597 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.538 HE22 ' CG ' ' A' ' 40' ' ' ASP . 3.5 mp0 -148.83 136.78 20.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.674 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.424 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -66.18 87.19 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.768 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.524 HD12 ' HB2' ' A' ' 38' ' ' PHE . 9.7 mt -86.57 124.07 40.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.047 0.451 . . . . 0.0 111.627 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.7 m -93.12 110.68 22.18 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.202 178.442 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.62 130.5 37.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.37 0.605 . . . . 0.0 112.084 -178.509 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -100.01 -42.04 6.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.24 179.366 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.7 50.13 0.78 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.296 -179.473 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -73.7 93.36 2.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.891 0.376 . . . . 0.0 110.691 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.061 -179.821 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 CA-C-O 120.726 0.298 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.543 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 3.3 p-10 -156.45 152.18 27.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.016 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -67.79 164.4 19.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.033 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.44 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.8 m -152.65 45.87 0.71 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.241 -179.596 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 138.32 24.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.743 0.306 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -143.76 114.65 7.76 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.539 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.44 ' O ' HG23 ' A' ' 7' ' ' VAL . 2.7 m -66.53 127.82 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.047 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -85.19 80.09 9.33 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.312 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -57.29 -70.38 0.13 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.398 0.618 . . . . 0.0 110.042 -179.003 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 60.0 t-20 -51.92 86.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.707 178.964 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.618 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.7 t80 -177.8 97.34 0.22 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.452 -179.027 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.537 ' O ' ' C ' ' A' ' 13' ' ' VAL . 79.8 Cg_exo -45.94 75.65 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.814 2.342 . . . . 0.0 112.978 -179.574 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.618 ' N ' ' O ' ' A' ' 11' ' ' TYR . 15.9 t -7.86 -62.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 O-C-N 123.798 0.686 . . . . 0.0 112.52 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.565 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 67.4 p 27.23 -92.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.481 -179.82 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.565 ' N ' ' OG ' ' A' ' 14' ' ' SER . 0.1 OUTLIER -68.9 156.49 38.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.54 -179.624 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 1.7 m -172.59 -37.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.73 52.04 1.39 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.298 0.571 . . . . 0.0 109.785 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.4 mt -161.95 96.24 1.0 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.282 -179.215 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.18 78.74 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.737 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.566 ' O ' ' N ' ' A' ' 24' ' ' TYR . 2.5 m-80 -162.01 -79.14 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.292 179.847 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.51 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -22.75 -86.16 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.347 179.844 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.487 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 1.9 m -57.55 -52.38 65.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.163 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -53.84 -75.18 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.573 -179.103 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.566 ' N ' ' O ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -48.94 -57.13 6.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.724 -179.077 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 29' ' ' ASP . 34.6 m-20 -52.11 -56.44 14.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.336 -179.453 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.527 ' C ' ' H ' ' A' ' 28' ' ' LEU . 94.9 m -50.44 -53.06 32.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.029 0.442 . . . . 0.0 110.064 179.834 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -61.99 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.335 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.4 tt -163.68 -40.82 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -179.759 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -67.2 -40.07 86.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.754 0.312 . . . . 0.0 110.764 -179.707 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -112.72 15.49 19.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.544 179.486 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.7 m170 52.04 44.37 29.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.852 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.61 -154.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.896 0.379 . . . . 0.0 111.121 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.2 mtp85 -142.52 -2.99 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.831 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.3 p -175.32 -179.83 1.38 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.728 -179.94 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 156.73 167.95 18.68 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.337 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -178.51 174.99 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.903 0.382 . . . . 0.0 110.901 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -86.54 133.9 33.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.1 179.661 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -144.98 148.6 33.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.057 0.456 . . . . 0.0 111.44 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -75.44 -179.73 4.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.456 -179.531 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.517 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -154.85 -179.86 8.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.072 179.9 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -61.4 0.62 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.946 0.403 . . . . 0.0 110.462 -179.979 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.517 ' H ' ' C ' ' A' ' 40' ' ' ASP . 25.4 mtmm -102.2 -12.65 17.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.164 -179.886 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.477 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 15.7 ttp180 83.16 -5.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -95.6 156.13 16.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.435 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.8 mp -91.44 157.4 17.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.037 0.446 . . . . 0.0 111.775 -179.568 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -146.03 143.7 29.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.786 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.2 m -79.34 97.96 6.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.7 mt -87.06 126.09 40.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.9 m -98.84 111.75 24.05 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.955 179.421 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -95.22 131.64 41.05 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -103.98 -37.01 7.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.862 -179.281 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.536 ' O ' ' N ' ' A' ' 54' ' ' TYR . 1.4 m -144.0 -11.49 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.706 -178.819 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 60.44 -71.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 110.88 -179.479 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 52' ' ' CYS . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.683 179.992 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.582 0 CA-C-O 120.739 0.304 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -64.9 -42.61 94.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.47 179.883 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -159.11 120.34 3.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.216 179.796 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.24 11.41 0.4 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.925 179.821 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 116.27 8.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.504 179.535 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.405 ' NZ ' ' OH ' ' A' ' 51' ' ' TYR . 11.2 pttm -152.46 135.99 16.04 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.253 -0.579 . . . . 0.0 112.1 -178.977 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.55 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -67.23 150.85 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.582 179.228 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.674 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -64.28 61.6 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.462 179.813 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 7' ' ' VAL . 2.8 mt-10 16.76 -140.65 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.38 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.78 12.52 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -178.202 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.623 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 67.3 t80 -50.98 143.11 16.14 Favored Pre-proline 0 N--CA 1.467 0.387 0 O-C-N 121.952 -0.468 . . . . 0.0 109.786 179.597 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.756 ' O ' HG23 ' A' ' 13' ' ' VAL . 9.4 Cg_endo -48.16 -88.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.876 1.717 . . . . 0.0 112.179 -179.596 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.756 HG23 ' O ' ' A' ' 12' ' ' PRO . 71.0 t 117.47 -8.12 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.638 1.175 . . . . 0.0 110.728 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 p -66.28 25.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.24 179.69 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.611 ' H ' ' C ' ' A' ' 13' ' ' VAL . 0.6 OUTLIER -172.02 99.57 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.96 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -171.25 27.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.815 -179.097 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.513 ' N ' ' CD ' ' A' ' 17' ' ' GLN . 1.7 mm100 -76.16 17.23 0.36 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.768 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' A' ' 16' ' ' CYS . 7.1 mt -163.42 -90.29 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.972 -179.848 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.92 -150.97 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.147 0.499 . . . . 0.0 110.995 -179.082 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.552 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.1 OUTLIER 67.0 -75.47 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.914 179.899 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.552 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 40.5 tp60 -38.13 -83.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 -179.667 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.623 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -57.68 -40.74 80.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 110.737 179.416 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.41 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 6.6 t-20 -56.66 -76.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.865 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.28 -40.38 24.67 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.845 179.946 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.439 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 65.6 m-20 -55.04 -68.52 0.18 Allowed 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.055 -179.787 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.674 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -54.52 -39.33 67.51 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.793 179.824 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? -60.77 6.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.088 179.723 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.486 ' H ' ' C ' ' A' ' 26' ' ' CYS . 17.4 tp -163.38 -36.77 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.546 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -67.68 -13.34 62.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.068 0.461 . . . . 0.0 110.351 -179.918 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -141.31 8.85 2.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.074 179.398 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 56.8 50.69 12.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.959 179.925 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.85 173.8 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.764 179.83 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -93.39 -51.2 5.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.294 179.886 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.3 p -160.96 126.57 3.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 179.871 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.41 ' O ' ' CG ' ' A' ' 23' ' ' ASN . . . -132.15 167.57 22.86 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.878 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -176.76 161.18 2.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.358 0.599 . . . . 0.0 111.003 -179.885 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -86.94 128.32 35.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.764 -179.737 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -125.62 148.75 48.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.043 0.449 . . . . 0.0 111.109 -179.725 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.625 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 25.2 m-85 -99.26 152.6 19.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.131 179.444 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 44' ' ' ASN . 0.3 OUTLIER -95.92 172.63 7.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.176 179.147 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -61.66 -2.02 0.71 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.035 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.434 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -97.59 -80.06 0.45 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.301 179.384 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.05 21.59 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.463 179.601 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.625 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -95.26 -165.1 1.24 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.767 0.318 . . . . 0.0 111.197 -179.964 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.551 HD11 ' CZ ' ' A' ' 39' ' ' TYR . 1.4 mt -146.22 147.06 31.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 0.0 111.057 -179.5 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -148.75 125.4 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 65.9 m -77.74 95.91 4.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.819 -179.92 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.436 HD13 HG12 ' A' ' 7' ' ' VAL . 3.3 mm -83.77 114.61 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.95 -179.428 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.5 m -106.04 111.84 24.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.317 178.984 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -96.82 153.85 17.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.064 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.405 ' OH ' ' NZ ' ' A' ' 6' ' ' LYS . 37.8 m-85 -121.06 -25.95 5.23 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.966 -178.889 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.2 m -93.55 -110.08 0.11 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.872 0.367 . . . . 0.0 111.245 -179.71 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -173.89 84.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.747 -179.473 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.775 -179.908 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.641 0 CA-C-O 120.867 0.365 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 0.3 OUTLIER -88.13 176.78 7.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.889 -179.875 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.22 127.59 7.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.293 179.96 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.416 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.2 m -155.24 33.63 0.38 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.144 0.497 . . . . 0.0 111.198 -179.606 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 tptm -98.43 132.06 44.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.536 179.686 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -149.26 117.42 6.39 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.887 0.375 . . . . 0.0 111.516 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.4 143.41 15.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.16 -179.908 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.407 ' CD1' ' NZ ' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -86.34 109.42 18.98 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.025 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.505 ' O ' ' O ' ' A' ' 10' ' ' ASN . 2.5 mt-10 -55.1 -174.79 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.477 -178.916 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.505 ' O ' ' O ' ' A' ' 9' ' ' GLU . 5.5 p30 17.57 104.6 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.855 0.722 . . . . 0.0 111.923 -179.575 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.532 ' C ' ' H ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -179.86 81.57 0.19 Allowed Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.272 -179.636 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.52 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 52.7 Cg_exo -56.79 5.93 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 123.235 2.624 . . . . 0.0 113.822 -178.793 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.532 ' H ' ' C ' ' A' ' 11' ' ' TYR . 90.7 t 101.87 -72.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.201 1.001 . . . . 0.0 111.505 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.491 ' C ' ' O ' ' A' ' 13' ' ' VAL . 7.0 p 27.72 89.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 14' ' ' SER . 1.0 OUTLIER 92.86 -123.63 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.426 -179.426 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER 78.94 -49.18 0.43 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.528 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.88 -12.88 8.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.082 0.468 . . . . 0.0 110.659 -179.568 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.628 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 0.8 OUTLIER -71.82 -45.08 62.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.094 179.885 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 101.98 3.86 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 O-C-N 123.773 0.67 . . . . 0.0 110.802 -179.619 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.595 ' O ' ' N ' ' A' ' 22' ' ' CYS . 60.4 t30 -97.03 -118.24 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.744 179.81 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 20' ' ' ASN . 84.7 mm-40 -1.14 -65.31 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.952 0.782 . . . . 0.0 112.326 179.677 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.4 t -57.11 -69.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.93 179.887 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.41 ' N ' ' O ' ' A' ' 20' ' ' ASN . 25.0 t30 -50.45 -51.06 50.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.27 179.933 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.49 -47.31 76.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.64 179.367 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.429 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 97.3 m-20 -57.19 -55.3 36.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.871 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.888 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 57.0 m -56.06 -47.57 77.68 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.869 179.724 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.86 8.83 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.112 178.902 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.673 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -162.79 -132.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.677 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.558 ' H ' HD13 ' A' ' 28' ' ' LEU . 1.6 m-20 39.85 -77.2 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.461 0.476 . . . . 0.0 111.897 -179.889 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.673 ' N ' ' O ' ' A' ' 28' ' ' LEU . 12.6 mttp -91.99 -4.91 53.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.719 0.295 . . . . 0.0 110.981 -179.769 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.526 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 1.3 m-70 82.99 44.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.642 179.391 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.888 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -88.0 172.7 9.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.26 179.276 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.41 HH21 ' HB2' ' A' ' 53' ' ' GLU . 2.9 tmm_? -95.73 -29.25 14.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.009 0.433 . . . . 0.0 110.49 179.921 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.7 p -174.54 -164.67 0.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.653 179.882 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 168.54 -178.5 42.01 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.348 -179.909 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -178.22 160.7 1.38 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.868 0.366 . . . . 0.0 110.622 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 137.27 32.48 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.566 -179.81 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -146.39 131.78 18.61 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.147 0.499 . . . . 0.0 112.202 -179.405 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.535 ' CZ ' ' O ' ' A' ' 43' ' ' ARG . 1.2 m-85 -39.04 163.51 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.598 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 44' ' ' ASN . 19.5 p30 -136.87 -161.76 1.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.192 179.504 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -63.1 -28.33 70.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.146 -179.664 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 24.0 mmmt -99.67 28.17 4.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.186 -179.794 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.535 ' O ' ' CZ ' ' A' ' 39' ' ' TYR . 28.8 mtm180 59.74 5.8 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.433 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 31.7 m120 -94.96 145.94 24.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.968 0.413 . . . . 0.0 111.215 -179.7 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.743 ' H ' HD23 ' A' ' 45' ' ' LEU . 0.3 OUTLIER -91.34 120.79 32.52 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -178.622 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -98.61 148.57 23.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.542 178.306 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -78.58 98.14 6.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.629 -179.383 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.4 mt -87.83 116.73 30.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.25 179.397 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.6 m -96.52 120.89 37.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 179.924 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.418 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 5.8 t70 -97.25 134.59 40.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.359 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -104.65 -28.43 11.23 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.667 -178.943 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.416 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m -144.75 67.73 1.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 0.0 111.384 -179.495 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.446 ' O ' ' C ' ' A' ' 54' ' ' TYR . 2.6 tp10 50.51 -95.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.954 179.595 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.446 ' C ' ' O ' ' A' ' 53' ' ' GLU . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.959 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.611 0 CA-C-O 120.823 0.344 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.406 ' O ' ' O ' ' A' ' 3' ' ' LYS . 72.6 m-20 -149.23 -81.25 0.12 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.041 -179.775 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.406 ' O ' ' O ' ' A' ' 2' ' ' ASP . 7.6 tmtt? 50.37 101.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.731 -179.859 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 172.39 24.86 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.044 -179.396 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.481 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -140.47 151.14 44.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.939 0.4 . . . . 0.0 111.8 -179.363 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -148.89 133.75 17.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.504 -179.771 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.8 m -65.66 139.75 20.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.649 179.778 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.474 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -81.51 54.33 2.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.859 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.609 ' O ' ' N ' ' A' ' 11' ' ' TYR . 13.1 mt-10 25.22 -145.59 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.784 -179.968 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.46 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.5 OUTLIER -57.62 58.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.104 -179.51 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.609 ' N ' ' O ' ' A' ' 9' ' ' GLU . 35.4 t80 -56.19 121.33 41.16 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 110.513 -0.18 . . . . 0.0 110.513 179.424 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -41.02 90.12 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.547 1.498 . . . . 0.0 111.292 179.096 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.537 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -51.45 95.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.222 0.534 . . . . 0.0 111.11 -179.276 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 91.0 p -175.25 130.66 0.29 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.54 -179.903 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.498 ' O ' ' C ' ' A' ' 16' ' ' CYS . 26.8 mttt 87.96 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.764 0.665 . . . . 0.0 110.919 -179.537 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.498 ' C ' ' O ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER 25.2 98.01 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.344 0.403 . . . . 0.0 111.282 179.953 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.426 ' O ' ' C ' ' A' ' 18' ' ' LEU . 31.7 mt-30 -120.65 50.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 -179.981 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.617 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 26.1 mt 36.5 89.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.909 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 103.28 149.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 124.107 0.879 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.608 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.2 OUTLIER 84.46 -68.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 179.547 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.608 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 6.7 mm-40 -49.43 -79.06 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.672 0.272 . . . . 0.0 111.011 -179.542 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.1 m -55.23 -39.17 69.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.916 0.388 . . . . 0.0 110.52 179.956 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -55.65 -81.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.594 179.45 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.72 -46.8 30.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.232 -179.855 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.444 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 3.6 m-20 -51.82 -66.53 0.37 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.461 0.172 . . . . 0.0 110.93 -179.66 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.554 ' C ' ' H ' ' A' ' 28' ' ' LEU . 28.8 m -55.36 -36.54 66.44 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.384 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -60.48 6.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.17 179.297 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.554 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.5 tp -159.64 -34.16 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.288 -179.384 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -70.61 -56.82 5.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.004 0.43 . . . . 0.0 110.111 179.293 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 2.1 mptt -102.61 21.3 15.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.336 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.2 p-80 35.43 45.17 0.21 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.154 0.502 . . . . 0.0 110.796 -179.943 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.09 -132.79 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.608 179.798 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -139.32 -31.12 0.7 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.294 179.382 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.2 p -167.33 -164.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.796 -179.931 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.09 -171.31 44.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -177.15 154.33 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.852 0.358 . . . . 0.0 110.983 -179.969 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 92.2 m -85.52 96.71 9.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.566 179.976 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.419 ' HB2' HD12 ' A' ' 48' ' ' ILE . 37.0 m-85 -108.12 163.0 13.54 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.194 -179.872 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.57 ' CE2' HD23 ' A' ' 45' ' ' LEU . 27.5 m-85 -87.03 -22.77 25.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.769 179.745 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.506 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.1 OUTLIER 48.0 171.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.803 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.74 39.58 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.469 -179.681 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.489 ' H ' ' C ' ' A' ' 40' ' ' ASP . 16.2 mtmt -144.64 -1.76 0.88 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.563 -179.666 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 41.76 65.91 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.233 0.539 . . . . 0.0 109.934 -179.515 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -138.94 0.97 2.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.325 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.57 HD23 ' CE2' ' A' ' 39' ' ' TYR . 1.1 tm? 51.63 63.86 2.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.012 0.434 . . . . 0.0 110.377 179.218 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -95.03 169.86 9.82 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.418 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -96.69 114.58 26.23 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.404 -179.753 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.419 HD12 ' HB2' ' A' ' 38' ' ' PHE . 23.4 mt -90.6 132.09 36.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.542 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.9 m -100.95 112.86 25.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.753 179.482 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.603 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 6.8 t70 -94.09 151.94 19.13 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.726 179.829 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -124.0 -29.3 3.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.251 -178.783 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.45 ' O ' ' C ' ' A' ' 53' ' ' GLU . 35.1 m -93.39 -103.39 0.13 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.766 0.317 . . . . 0.0 111.143 -179.588 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.45 ' C ' ' O ' ' A' ' 52' ' ' CYS . 16.9 tt0 -32.41 112.36 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.207 -179.553 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.012 -179.945 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 120.847 0.356 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.484 ' O ' ' O ' ' A' ' 3' ' ' LYS . 22.8 t0 69.47 -79.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.711 -179.736 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 2' ' ' ASP . 11.0 tptt 33.29 -156.69 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.058 -179.938 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.42 ' H ' ' CG ' ' A' ' 3' ' ' LYS . 93.4 m -149.48 46.18 0.96 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.904 0.383 . . . . 0.0 111.21 -179.503 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' CD ' ' A' ' 5' ' ' LYS . 2.5 tmtt? -145.94 131.46 18.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.13 114.26 5.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.07 -179.949 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.417 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.0 OUTLIER -64.67 130.95 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.304 179.956 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.531 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -71.59 64.26 0.44 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.03 0.443 . . . . 0.0 110.344 179.781 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' N ' ' A' ' 11' ' ' TYR . 3.4 mt-10 29.26 -156.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.147 179.366 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -59.44 47.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.386 -179.315 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.605 ' O ' ' O ' ' A' ' 12' ' ' PRO . 58.2 t80 -52.25 145.3 19.45 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.183 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.605 ' O ' ' O ' ' A' ' 11' ' ' TYR . 73.8 Cg_exo -49.58 -139.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.895 1.73 . . . . 0.0 112.597 179.863 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.587 ' C ' ' H ' ' A' ' 15' ' ' LYS . 0.5 OUTLIER -179.26 -19.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.743 179.852 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.3 p -64.24 19.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -179.906 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.587 ' H ' ' C ' ' A' ' 13' ' ' VAL . 1.7 tttm -173.89 104.76 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.925 0.393 . . . . 0.0 111.502 -179.909 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.84 110.89 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.072 179.424 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -127.46 -54.02 1.35 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.822 -179.649 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.679 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 0.4 OUTLIER -179.31 89.44 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.794 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 96.71 174.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.491 0.662 . . . . 0.0 112.62 178.219 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 71.89 -78.31 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.819 179.265 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -39.04 -85.03 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.581 -179.051 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.8 m -58.15 -40.39 81.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.701 -179.346 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -52.98 -70.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.529 -179.506 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.572 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.55 -54.61 25.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.705 0.288 . . . . 0.0 111.114 -179.551 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.516 ' O ' ' N ' ' A' ' 29' ' ' ASP . 29.9 m-20 -49.57 -60.69 2.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.926 -179.514 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 37.9 m -54.98 -32.7 61.83 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.97 179.65 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.24 0.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.318 179.512 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -165.05 -37.12 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 -179.204 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.516 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -65.84 -16.87 64.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.767 0.318 . . . . 0.0 111.101 -179.314 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mmtt -142.6 5.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.967 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.8 36.9 19.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.767 179.897 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.38 -169.76 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.387 -179.744 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.434 ' H ' ' HA ' ' A' ' 51' ' ' TYR . 8.4 tpm_? -97.85 -20.9 17.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.655 179.992 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p 171.31 -163.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.334 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.65 -175.22 46.28 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.589 179.901 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -175.81 158.48 2.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 0.0 110.407 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 3.8 m -87.52 130.53 34.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.49 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -149.21 165.84 30.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.776 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.611 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.3 m-85 -81.88 166.86 19.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.35 179.705 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -124.38 87.08 2.66 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.162 0.506 . . . . 0.0 111.035 179.956 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' A' ' 40' ' ' ASP . 59.1 mt-10 21.25 41.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.5 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.605 ' N ' ' O ' ' A' ' 40' ' ' ASP . 5.0 ttmm -147.13 -76.47 0.18 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.949 0.404 . . . . 0.0 110.979 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 162.71 58.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.558 -179.959 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.611 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 20.2 m-80 -141.01 -164.05 1.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.337 -179.684 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.3 tp -152.64 82.77 1.23 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.857 -179.656 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -92.33 165.63 12.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.21 -179.73 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.0 110.47 22.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.342 -179.696 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.575 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.9 mp -89.22 122.25 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.209 179.541 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -93.57 113.39 25.49 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.902 0.382 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -95.2 139.83 30.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.889 -179.819 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.434 ' HA ' ' H ' ' A' ' 33' ' ' ARG . 67.6 m-85 -106.95 -11.95 15.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.167 -179.62 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.555 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 56.5 m -143.09 -108.87 0.13 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.263 -179.448 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.555 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 5.3 tt0 89.97 -76.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 -179.662 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.435 ' C ' ' O ' ' A' ' 53' ' ' GLU . 3.2 m-85 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.055 179.747 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 120.704 0.288 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.485 ' O ' ' O ' ' A' ' 3' ' ' LYS . 3.6 t0 -59.94 -39.65 86.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.27 -179.68 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.57 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 11.8 tppt? 57.57 134.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.72 -179.784 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.57 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.4 m 175.66 -20.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.633 -179.815 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.4 122.56 40.58 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.905 179.12 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' HZ3' ' HD2' ' A' ' 3' ' ' LYS . 2.5 mttm -148.78 144.49 27.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 111.206 -179.064 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.509 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 21.7 m -62.24 162.25 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 CA-C-O 121.165 0.507 . . . . 0.0 111.068 179.52 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.539 ' CD1' ' C ' ' A' ' 8' ' ' TYR . 3.5 p90 -67.71 -29.56 68.84 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.799 -179.653 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.548 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER 26.81 101.87 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.538 -177.458 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.548 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 11.9 m120 104.91 79.76 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.832 179.903 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.55 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.7 t80 170.42 96.47 0.04 OUTLIER Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.512 179.125 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.579 ' O ' ' N ' ' A' ' 14' ' ' SER . 96.1 Cg_exo -44.86 112.1 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.208 1.938 . . . . 0.0 112.399 -179.996 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.59 73.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.429 -179.838 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.579 ' N ' ' O ' ' A' ' 12' ' ' PRO . 9.2 p -63.79 -24.4 67.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.634 179.641 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -173.48 165.11 4.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.159 179.645 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -173.42 10.37 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -89.0 -33.44 17.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 0.0 110.719 179.863 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.58 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 3.3 mt -70.89 -58.61 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.547 -179.941 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.58 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 105.35 59.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.884 0.74 . . . . 0.0 110.974 -179.256 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.54 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 16.4 p30 -155.35 -51.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.702 179.695 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.54 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -47.93 -76.74 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.475 179.926 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.55 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -59.74 -42.38 93.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.734 0.302 . . . . 0.0 110.939 179.789 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 52.1 t30 -54.7 -76.97 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.106 179.883 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.95 -37.81 21.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.346 179.832 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.598 ' O ' ' N ' ' A' ' 29' ' ' ASP . 68.0 m-20 -55.5 -69.58 0.13 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.655 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.52 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -51.66 -38.16 53.65 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.904 179.828 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.408 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 3.5 mtpt -57.93 3.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.117 179.368 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.52 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.01 -43.64 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.864 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.598 ' N ' ' O ' ' A' ' 25' ' ' ASP . 84.2 m-20 -68.17 -8.08 35.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.699 0.285 . . . . 0.0 111.301 -179.429 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -140.29 13.32 2.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.779 179.925 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 22.0 m170 59.94 38.17 21.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.977 179.321 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.49 -166.13 1.52 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.649 179.181 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.408 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 46.7 ttt180 -129.54 -48.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.972 0.415 . . . . 0.0 110.448 179.558 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.447 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 1.1 p -158.53 124.39 4.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.268 179.531 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.445 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -130.18 -176.53 14.46 Favored Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.38 -0.914 . . . . 0.0 113.649 -179.234 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -174.93 158.77 2.59 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.537 0.208 . . . . 0.0 110.776 179.929 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 139.03 30.93 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.606 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -149.29 154.34 38.87 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.511 ' HB3' HD12 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -163.52 172.58 14.22 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.902 -179.43 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.524 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -139.4 -160.65 1.09 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.818 0.342 . . . . 0.0 111.241 -178.964 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.473 ' CG ' ' O ' ' A' ' 41' ' ' GLU . 38.5 tt0 -60.05 3.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.115 -179.417 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.541 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.3 OUTLIER -94.18 4.65 53.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.233 0.539 . . . . 0.0 109.925 179.48 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 46.33 10.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.015 -179.8 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.541 ' H ' ' C ' ' A' ' 42' ' ' LYS . 84.5 m-20 -94.68 97.19 9.91 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.143 0.497 . . . . 0.0 110.274 179.462 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.511 HD12 ' HB3' ' A' ' 39' ' ' TYR . 6.4 tp -89.47 130.31 35.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.677 -178.942 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -137.28 154.57 50.08 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.152 -179.009 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -92.94 111.78 23.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.33 179.834 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.5 mm -80.46 109.94 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.365 179.059 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 m -96.87 115.35 27.27 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.47 0.481 . . . . 0.0 110.721 -179.444 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' A' ' 34' ' ' SER . 1.0 OUTLIER -95.24 131.83 40.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.176 -179.67 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -101.9 -17.4 16.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.178 -179.42 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.9 m -144.1 -19.16 0.57 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.489 -179.977 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 59.28 71.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.731 0.301 . . . . 0.0 110.906 -179.88 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.146 -0.93 . . . . 0.0 110.767 179.945 . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.508 0 CA-C-O 120.841 0.353 . . . . 0.0 111.357 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.539 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 0.0 OUTLIER 61.39 156.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.366 179.851 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.74 36.2 2.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.278 179.972 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.489 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.5 m 47.21 22.52 0.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.938 179.785 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.7 137.77 32.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.481 -179.606 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -149.22 123.01 9.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.497 179.681 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.15 142.63 16.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -81.26 103.16 10.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.435 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.54 ' O ' ' C ' ' A' ' 10' ' ' ASN . 15.4 mm-40 -59.54 168.28 1.67 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.399 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.54 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 11.42 108.21 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.849 0.718 . . . . 0.0 111.883 -179.567 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -177.97 143.48 0.48 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.698 -179.789 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.414 ' C ' ' O ' ' A' ' 11' ' ' TYR . 33.0 Cg_exo -28.98 83.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.179 2.586 . . . . 0.0 113.316 -179.686 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.571 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -58.26 -39.48 73.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.148 179.468 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.23 -39.25 94.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.208 -179.763 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 91.29 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.914 0.388 . . . . 0.0 110.868 -179.908 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.46 ' HA ' HE21 ' A' ' 21' ' ' GLN . 0.1 OUTLIER -172.86 111.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.392 -179.689 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.512 ' H ' HE21 ' A' ' 21' ' ' GLN . 1.8 mt-30 -149.13 -22.4 0.3 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.504 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.486 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -166.22 176.73 7.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.212 0.529 . . . . 0.0 111.518 -179.27 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.475 ' C ' ' OD1' ' A' ' 20' ' ' ASN . . . -58.71 103.45 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.85 -179.999 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.547 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.6 p-10 176.24 -88.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.973 178.982 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.518 ' OE1' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -27.57 -85.63 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.418 -0.113 . . . . 0.0 111.231 -179.84 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.565 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 0.8 OUTLIER -52.33 -56.58 13.9 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.6 0.238 . . . . 0.0 111.269 -179.77 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -49.05 -74.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.102 0.477 . . . . 0.0 110.49 179.968 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.547 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -49.84 -42.49 47.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.399 179.685 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 29' ' ' ASP . 69.1 m-20 -55.19 -66.47 0.4 Allowed 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.649 -179.688 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 1.8 m -52.69 -39.68 62.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.26 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tptm -57.16 2.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.151 179.849 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.499 ' H ' ' C ' ' A' ' 26' ' ' CYS . 64.0 tp -163.78 -37.56 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -66.81 -51.62 53.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.891 0.377 . . . . 0.0 110.505 179.926 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.519 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -106.12 6.48 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.306 179.8 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.519 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 47.12 49.28 15.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.703 -179.859 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.523 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.55 -127.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.444 179.37 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.25 -42.89 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.993 0.425 . . . . 0.0 110.623 179.924 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -158.43 -163.51 1.29 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.32 179.964 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.407 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . 167.14 174.69 36.53 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.525 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -175.57 168.73 3.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.778 0.323 . . . . 0.0 110.561 -179.951 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.5 m -88.06 147.49 24.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.277 -179.469 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -146.93 131.41 17.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.606 179.812 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.617 ' CD1' ' O ' ' A' ' 44' ' ' ASN . 21.1 m-85 -74.14 -172.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.399 -179.444 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.502 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 0.8 OUTLIER -163.47 -171.48 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.882 -179.932 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.13 -20.0 63.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.261 -179.638 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 43' ' ' ARG . 19.7 mmtt -99.43 29.11 4.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.046 179.871 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LYS . 11.9 ttt180 35.76 34.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.83 -179.957 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.617 ' O ' ' CD1' ' A' ' 39' ' ' TYR . 1.0 OUTLIER -94.6 -162.84 0.98 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 -179.949 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.0 mt -146.22 100.06 3.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 110.991 -179.58 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -92.96 149.69 21.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 179.842 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.51 110.31 22.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.116 -179.552 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.407 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 9.6 mm -87.95 128.26 40.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 179.984 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 61.1 m -108.39 116.65 32.36 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 179.513 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.523 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -94.82 133.39 38.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.915 0.388 . . . . 0.0 110.116 179.324 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -100.66 -33.8 10.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.2 -178.751 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.489 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -148.62 -93.26 0.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.654 -179.8 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 179.28 -34.26 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.909 0.385 . . . . 0.0 110.165 179.819 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.295 -0.86 . . . . 0.0 110.615 -179.85 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.622 0 CA-C-O 120.756 0.312 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.81 -103.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.86 -179.939 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.599 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -144.51 131.62 20.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.085 -179.807 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.3 m 159.53 45.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.981 -179.99 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -143.97 92.96 2.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.71 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -96.3 127.46 42.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.691 0.281 . . . . 0.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.2 m -66.03 133.65 30.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 112.091 -179.787 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.483 ' O ' ' O ' ' A' ' 9' ' ' GLU . 13.5 t80 -77.09 93.84 3.94 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.688 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' O ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -47.96 -179.21 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.303 -177.922 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.579 ' O ' ' O ' ' A' ' 9' ' ' GLU . 43.5 m-20 16.34 109.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.675 0.609 . . . . 0.0 111.987 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.674 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 12.8 t80 -173.07 144.52 1.18 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.144 -179.071 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.93 ' O ' HG23 ' A' ' 13' ' ' VAL . 81.2 Cg_exo -43.56 -134.86 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 123.108 2.539 . . . . 0.0 113.831 -179.378 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 12' ' ' PRO . 2.2 t -177.46 -56.52 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.879 -179.031 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.8 p -60.08 66.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.865 -178.729 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.697 ' O ' ' N ' ' A' ' 17' ' ' GLN . 4.5 mttm -174.47 -68.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.29 179.201 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.721 ' O ' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER 13.04 -66.5 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 178.94 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.697 ' N ' ' O ' ' A' ' 15' ' ' LYS . 23.4 mt-30 -54.65 51.52 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.638 0.586 . . . . 0.0 111.842 -178.744 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.721 ' N ' ' O ' ' A' ' 16' ' ' CYS . 11.7 mt -165.45 98.79 0.7 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.606 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.51 86.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.849 -179.424 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.612 ' O ' ' N ' ' A' ' 22' ' ' CYS . 3.7 t-20 -173.51 -78.12 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.816 -179.757 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.607 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER -60.46 41.4 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.521 -179.921 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 15.6 m -170.23 -59.01 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.147 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 27' ' ' LYS . 1.0 OUTLIER -56.69 -54.54 45.03 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.576 178.112 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.544 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.92 -47.91 76.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.028 178.957 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.628 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.0 m-20 -58.09 -68.75 0.22 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.409 -179.983 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.504 ' C ' ' H ' ' A' ' 28' ' ' LEU . 56.2 m -51.87 -41.46 61.89 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.023 -179.94 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.455 ' CG ' ' O ' ' A' ' 27' ' ' LYS . 17.0 tttp -59.83 6.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.08 179.776 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.2 tp -164.68 -41.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.532 -0.467 . . . . 0.0 112.121 -179.396 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.628 ' N ' ' O ' ' A' ' 25' ' ' ASP . 55.4 m-20 -69.27 -12.98 62.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.29 -179.746 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.548 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 1.1 mptm? -138.19 6.05 2.56 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.831 0.348 . . . . 0.0 110.639 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.548 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 52.38 35.52 17.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.231 0.539 . . . . 0.0 110.447 -179.818 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.53 -167.22 1.76 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.649 179.702 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.01 -31.04 13.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.11 0.481 . . . . 0.0 109.856 179.63 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -171.93 -175.16 1.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.836 179.719 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.429 ' N ' ' HA ' ' A' ' 23' ' ' ASN . . . -152.11 95.23 0.15 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 119.965 -1.112 . . . . 0.0 113.519 -179.733 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.598 ' CG ' ' H ' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -74.76 -159.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.369 0.604 . . . . 0.0 111.894 179.775 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -153.25 137.69 16.73 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.305 179.559 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -150.71 158.91 44.71 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -178.538 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.764 ' CG ' ' N ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -169.75 -153.71 0.11 Allowed 'General case' 0 C--N 1.343 0.318 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.228 179.548 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.764 ' N ' ' CG ' ' A' ' 39' ' ' TYR . 0.2 OUTLIER 175.12 95.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.63 0.252 . . . . 0.0 111.131 179.333 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.411 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 8.5 mt-10 87.11 -70.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.704 179.565 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.642 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -150.38 29.23 0.71 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -179.665 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.643 ' C ' ' H ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -65.11 16.19 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.954 -179.328 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.642 ' H ' ' C ' ' A' ' 42' ' ' LYS . 30.4 m120 63.15 -15.82 0.06 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.261 -179.919 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.656 HD12 ' N ' ' A' ' 46' ' ' GLN . 4.3 tp 59.5 133.43 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.904 177.873 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.656 ' N ' HD12 ' A' ' 45' ' ' LEU . 1.8 mp0 -141.34 165.05 28.59 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.555 0.693 . . . . 0.0 112.571 -178.514 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.674 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 63.0 m -80.65 110.15 15.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.037 -179.965 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.423 ' O ' ' N ' ' A' ' 36' ' ' GLU . 1.4 mp -93.6 126.23 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.888 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 98.5 m -88.98 117.23 27.84 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.439 179.688 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.573 ' OD1' ' N ' ' A' ' 53' ' ' GLU . 6.8 t70 -93.48 121.13 34.57 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.386 179.481 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -100.38 -17.36 17.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.931 -179.121 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.475 ' O ' ' C ' ' A' ' 53' ' ' GLU . 5.7 m -141.83 56.08 1.49 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.142 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.573 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 1.9 tm-20 28.85 -92.75 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.422 179.332 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.458 ' N ' ' O ' ' A' ' 52' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.77 -179.9 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.59 0 CA-C-O 120.752 0.31 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.529 ' CG ' ' H ' ' A' ' 3' ' ' LYS . 15.4 p30 -147.79 -82.86 0.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.742 179.7 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.589 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -86.09 111.29 20.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.072 0.463 . . . . 0.0 110.877 179.984 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -45.88 -31.52 2.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.481 179.942 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -90.86 133.63 35.08 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.196 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.589 ' NZ ' ' O ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -146.79 122.56 10.57 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.087 178.786 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.0 m -60.87 145.33 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 0.0 111.561 -179.695 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.523 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -87.64 60.35 5.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.001 179.418 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.552 ' C ' ' H ' ' A' ' 11' ' ' TYR . 35.5 mt-10 30.57 -158.61 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.021 179.707 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.54 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.5 OUTLIER -58.48 34.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.649 -179.149 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.677 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 5.5 t80 -50.92 135.16 28.22 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.486 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.447 ' C ' ' O ' ' A' ' 11' ' ' TYR . 39.9 Cg_exo -30.95 84.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.329 2.02 . . . . 0.0 112.318 179.512 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.605 ' N ' ' O ' ' A' ' 11' ' ' TYR . 42.9 t -55.77 -15.64 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.956 -179.536 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.4 p -62.16 -93.71 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.8 -179.196 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -67.82 153.25 44.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.331 0.586 . . . . 0.0 112.35 -178.793 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -174.52 -67.99 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.471 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.413 ' O ' ' C ' ' A' ' 18' ' ' LEU . 6.0 mm100 56.37 28.17 13.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.016 0.436 . . . . 0.0 111.065 179.59 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.659 HD23 ' H ' ' A' ' 37' ' ' CYS . 40.4 mt 35.59 75.9 0.05 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.22 179.542 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -178.56 -147.94 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.343 179.719 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.635 ' ND2' ' OE1' ' A' ' 21' ' ' GLN . 21.8 t30 -21.14 -107.96 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.453 -179.377 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.635 ' OE1' ' ND2' ' A' ' 20' ' ' ASN . 4.6 mm100 -5.81 -73.88 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.245 -179.575 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.6 t -57.5 -68.61 0.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.478 179.923 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -48.38 -59.5 3.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 -179.69 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.422 179.583 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.636 ' O ' ' N ' ' A' ' 29' ' ' ASP . 22.4 m-20 -50.93 -60.53 2.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.29 179.751 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.2 m -53.1 -53.98 42.3 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.714 179.278 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 14.27 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.672 -179.832 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.735 ' C ' HD13 ' A' ' 28' ' ' LEU . 2.8 tm? -165.02 -52.19 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 119.876 -0.729 . . . . 0.0 112.613 -179.483 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.636 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -66.05 -15.72 63.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.574 0.226 . . . . 0.0 111.094 -179.06 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -134.31 13.16 3.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.733 0.301 . . . . 0.0 110.834 -179.973 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.4 m80 46.29 36.46 3.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.947 -179.955 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.4 -172.93 4.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.76 179.892 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -95.96 -45.31 6.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.889 179.959 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.3 p -177.55 154.74 1.01 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.534 179.833 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.63 -164.87 16.34 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.125 -1.036 . . . . 0.0 113.254 -179.684 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -177.19 175.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.699 0.285 . . . . 0.0 110.448 -179.864 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.659 ' H ' HD23 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -88.19 149.49 23.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.135 0.493 . . . . 0.0 111.918 -179.834 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' A' ' 37' ' ' CYS . 26.5 m-85 -148.91 145.68 27.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.168 179.388 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.501 ' O ' ' O ' ' A' ' 44' ' ' ASN . 17.0 m-85 -73.79 -102.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -179.522 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.463 ' CG ' ' O ' ' A' ' 39' ' ' TYR . 0.6 OUTLIER 48.97 -167.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.264 0.554 . . . . 0.0 111.086 -179.788 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER 27.64 63.17 0.1 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.307 -178.85 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.513 ' O ' ' N ' ' A' ' 44' ' ' ASN . 5.5 ttpt 69.68 65.95 0.25 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 178.655 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.475 ' HD3' ' H ' ' A' ' 43' ' ' ARG . 8.7 mmt85 32.76 33.51 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.558 178.986 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.513 ' N ' ' O ' ' A' ' 42' ' ' LYS . 10.5 m-20 -95.64 129.93 42.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 178.891 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.08 86.38 7.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.13 0.49 . . . . 0.0 110.988 -179.574 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -89.64 158.46 17.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.658 179.832 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.677 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -99.67 108.94 21.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.641 -179.506 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.2 mt -85.83 110.22 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.076 179.498 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.2 m -97.34 121.96 39.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.538 179.438 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.477 ' OD2' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -98.91 134.86 41.17 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.516 0.674 . . . . 0.0 110.859 179.791 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -121.0 66.41 0.86 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.28 -178.917 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.477 ' SG ' ' OD2' ' A' ' 50' ' ' ASP . 77.8 m -99.64 27.47 5.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.777 0.322 . . . . 0.0 111.457 -179.709 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.49 ' CG ' ' O ' ' A' ' 53' ' ' GLU . 5.4 pt-20 -80.98 112.65 18.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.356 179.306 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.533 ' CD1' ' C ' ' A' ' 54' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.863 -179.876 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 1' ' ' PCA . . . . . 0.457 ' O ' ' O ' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.637 0 CA-C-O 120.814 0.34 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 1' ' ' PCA . 16.2 t0 -56.11 -151.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.195 -179.78 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -65.18 146.3 55.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.0 -179.923 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -124.15 -52.56 1.75 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.283 179.326 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.654 ' CD ' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -97.87 145.37 26.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.069 0.462 . . . . 0.0 111.039 179.904 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -153.95 110.3 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.763 179.864 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -61.31 137.06 24.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.9 0.381 . . . . 0.0 111.656 -179.869 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.514 ' O ' ' C ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -64.51 66.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.598 179.056 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 7' ' ' VAL . 12.6 mp0 17.21 -115.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.415 178.99 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.542 ' O ' ' C ' ' A' ' 11' ' ' TYR . 7.8 m-20 -50.34 -72.22 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.784 -179.816 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.663 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 2.4 t80 10.89 79.24 0.06 OUTLIER Pre-proline 0 N--CA 1.466 0.365 0 O-C-N 123.791 0.682 . . . . 0.0 112.147 -178.836 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -46.54 -53.35 6.16 Favored 'Trans proline' 0 CA--C 1.518 -0.304 0 C-N-CA 122.877 2.385 . . . . 0.0 112.524 -179.675 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.49 ' O ' ' C ' ' A' ' 14' ' ' SER . 1.2 t 173.58 -50.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.52 179.615 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.551 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 5.5 p 23.05 55.23 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.875 -179.812 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.551 ' CB ' ' O ' ' A' ' 14' ' ' SER . 28.1 tptt 92.86 141.0 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.489 179.559 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.1 m -174.35 21.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.959 179.795 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -101.03 44.65 1.0 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.342 0.592 . . . . 0.0 110.702 -179.783 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.9 mt -158.84 -129.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.449 179.744 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.43 46.66 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.531 -179.653 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.509 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.1 OUTLIER -141.33 -47.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.611 179.795 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.509 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 5.7 tp60 -47.96 -80.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.835 179.904 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.663 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 22.5 m -62.48 -33.67 75.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.385 -179.902 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.494 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 3.0 t-20 -53.46 -65.79 0.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.014 0.435 . . . . 0.0 109.87 179.29 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.569 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.05 -38.58 68.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.071 178.968 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 29' ' ' ASP . 25.2 m-20 -52.45 -63.45 1.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.397 179.622 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.433 ' C ' ' H ' ' A' ' 28' ' ' LEU . 36.8 m -55.27 -39.31 69.68 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.08 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -59.37 3.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.586 -179.6 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' A' ' 26' ' ' CYS . 36.1 tp -165.93 -33.2 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.582 ' N ' ' O ' ' A' ' 25' ' ' ASP . 4.7 m-20 -65.83 -16.7 64.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.893 0.378 . . . . 0.0 110.487 -179.656 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.1 mtpm? -144.57 0.29 0.99 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.032 179.801 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m80 62.39 39.08 12.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.455 179.719 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.894 ' HB2' ' CZ ' ' A' ' 51' ' ' TYR . . . -86.81 -171.02 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.676 179.538 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.603 ' NE ' ' H ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -89.28 -39.0 13.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.768 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.479 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.3 p -175.85 -147.33 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.294 179.666 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.494 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . 149.24 173.48 19.9 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.555 -0.831 . . . . 0.0 113.36 179.952 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.45 ' CD ' ' O ' ' A' ' 35' ' ' GLY . 1.3 pm0 -175.11 172.41 2.81 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.683 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 145.64 25.61 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.663 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -145.15 149.34 34.82 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.35 179.551 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.604 ' CZ ' HD11 ' A' ' 45' ' ' LEU . 26.5 m-85 -80.54 150.44 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 111.355 -179.637 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 43' ' ' ARG . 24.8 p30 -99.12 -178.17 3.85 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.144 -179.863 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -63.01 -12.15 24.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.509 -179.477 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -94.92 -77.28 0.47 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.233 179.526 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.402 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 3.1 ptp180 175.45 1.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.329 -0.851 . . . . 0.0 112.161 179.482 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -93.97 151.64 19.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 111.316 -179.366 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.675 ' N ' HD12 ' A' ' 45' ' ' LEU . 2.9 mp -91.02 153.9 19.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.201 -179.707 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -144.52 132.7 21.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.278 179.689 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 83.8 m -81.35 105.58 12.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 112.073 -179.005 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.1 mt -88.47 120.73 37.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.188 179.43 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.2 m -92.67 119.38 32.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.402 178.889 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.747 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 20.5 t0 -86.63 144.93 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.514 -179.303 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.894 ' CZ ' ' HB2' ' A' ' 32' ' ' ALA . 83.6 m-85 -138.84 42.15 2.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.36 -178.793 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.611 ' O ' ' N ' ' A' ' 54' ' ' TYR . 71.0 m -91.38 -84.65 0.25 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.666 -178.869 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.603 ' H ' ' NE ' ' A' ' 33' ' ' ARG . 8.3 tt0 14.27 -77.46 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.798 0.686 . . . . 0.0 111.881 179.961 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.611 ' N ' ' O ' ' A' ' 52' ' ' CYS . 9.3 m-85 . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.705 179.69 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 1' ' ' PCA . . . . . 0.428 ' C ' ' OD1' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.447 -0.579 0 CA-C-O 120.799 0.333 . . . . 0.0 111.336 . . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.428 ' OD1' ' C ' ' A' ' 1' ' ' PCA . 0.5 OUTLIER 37.88 -103.25 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.087 179.982 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.597 ' C ' ' H ' ' A' ' 5' ' ' LYS . 22.3 mmtm 59.73 172.32 0.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.97 0.414 . . . . 0.0 111.441 179.923 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 27.7 m 62.93 -24.87 0.06 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.966 179.948 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.597 ' H ' ' C ' ' A' ' 3' ' ' LYS . 10.2 mtpp -142.58 103.61 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.65 0.262 . . . . 0.0 110.465 179.859 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -142.05 131.67 24.01 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.219 0.533 . . . . 0.0 111.635 -179.502 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.781 HG23 ' H ' ' A' ' 9' ' ' GLU . 2.4 m -66.57 153.19 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.107 178.745 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.585 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.4 OUTLIER -81.81 36.3 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.086 0.47 . . . . 0.0 110.154 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.781 ' H ' HG23 ' A' ' 7' ' ' VAL . 2.3 pt-20 10.86 -100.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.946 179.066 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 11' ' ' TYR . 2.7 m120 -43.22 -72.45 0.06 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.501 -178.767 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.529 ' C ' ' O ' ' A' ' 10' ' ' ASN . 33.5 t80 16.57 102.12 0.02 OUTLIER Pre-proline 0 N--CA 1.469 0.508 0 O-C-N 123.471 0.482 . . . . 0.0 111.819 -178.93 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -42.6 93.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.319 2.012 . . . . 0.0 112.936 -179.568 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.9 t -56.2 96.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.9 p -178.57 23.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.119 179.633 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -174.45 107.71 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.378 -179.987 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -170.25 -10.58 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.156 -179.373 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -62.57 19.69 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.757 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.623 ' H ' ' C ' ' A' ' 16' ' ' CYS . 14.0 mt -164.73 134.32 3.73 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.741 0.305 . . . . 0.0 110.324 179.954 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.428 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.16 -176.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 0.0 111.265 179.652 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.4 OUTLIER 81.9 -78.34 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.753 -179.828 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.49 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -29.15 -83.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.079 179.982 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.39 -46.07 91.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.061 0.458 . . . . 0.0 110.926 179.548 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.441 ' HA ' ' H ' ' A' ' 35' ' ' GLY . 0.1 OUTLIER -52.82 -75.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.22 -179.634 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.516 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -47.43 -47.19 26.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.869 -179.947 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.583 ' O ' ' N ' ' A' ' 29' ' ' ASP . 88.7 m-20 -52.12 -73.64 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.575 -179.248 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -51.59 -38.29 53.82 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.913 -179.833 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.405 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 64.9 tttt -63.15 7.18 0.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.964 179.392 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.478 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.8 tt -161.96 -22.29 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.859 -179.529 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -69.32 -55.59 10.01 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.025 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -101.17 3.44 41.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.134 179.312 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.9 m80 70.66 45.29 0.59 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.665 -179.547 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.49 -143.95 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.32 -179.717 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 50' ' ' ASP . 0.6 OUTLIER -142.54 -31.68 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.136 179.977 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 p -157.52 117.69 3.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.819 0.343 . . . . 0.0 111.876 -179.635 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.441 ' H ' ' HA ' ' A' ' 23' ' ' ASN . . . -104.6 71.86 0.25 Allowed Glycine 0 C--N 1.337 0.584 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.596 179.731 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -73.25 179.5 3.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.116 0.484 . . . . 0.0 111.816 -179.998 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -148.17 142.51 26.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.941 179.587 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -148.7 143.41 26.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -178.769 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.479 ' CD1' ' C ' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -169.71 159.01 7.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.195 -1.366 . . . . 0.0 109.841 179.034 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -96.62 -82.51 0.4 Allowed 'General case' 0 CA--C 1.502 -0.87 0 CA-C-O 121.214 0.53 . . . . 0.0 111.91 -178.966 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.487 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -165.48 8.26 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.515 -179.657 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.414 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -98.12 2.93 49.1 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.768 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.414 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER 80.69 21.13 0.45 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.201 179.917 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -94.14 74.46 4.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-O 121.604 0.716 . . . . 0.0 109.845 179.001 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.2 tp -97.81 139.1 34.18 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.517 -1.22 . . . . 0.0 112.6 -178.09 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -141.85 144.89 34.1 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.022 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -97.38 110.1 22.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.808 -179.835 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -87.71 112.21 23.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 179.774 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.2 m -105.85 104.37 14.07 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.291 179.929 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 33' ' ' ARG . 4.3 t70 -96.16 136.18 36.97 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.008 179.275 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -101.84 -24.45 14.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.7 -178.548 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.603 ' O ' ' CG ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -137.81 -82.99 0.33 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.136 179.803 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.603 ' CG ' ' O ' ' A' ' 52' ' ' CYS . 0.3 OUTLIER 119.63 27.2 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.717 0 O-C-N 124.534 1.147 . . . . 0.0 110.292 179.854 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 53' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.498 179.783 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.593 0 CA-C-O 120.785 0.326 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -100.73 169.97 8.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 -179.983 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.13 -168.8 2.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.579 179.91 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m -116.03 -45.73 2.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.362 -179.633 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -97.07 146.16 25.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.487 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 mtpm? -150.33 121.34 7.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.994 0.426 . . . . 0.0 111.376 -179.942 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.428 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.0 OUTLIER -66.04 151.3 10.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.902 179.407 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.555 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.6 OUTLIER -83.88 81.88 8.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.687 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 17.0 pt-20 -61.61 72.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.616 -179.495 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.579 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 31.4 t30 127.04 101.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.511 1.132 . . . . 0.0 110.527 -179.871 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -179.3 134.15 0.28 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.61 ' O ' ' N ' ' A' ' 14' ' ' SER . 89.0 Cg_endo -79.58 122.54 5.05 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.171 1.914 . . . . 0.0 112.553 -179.972 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.6 t -61.16 43.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.243 179.606 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.61 ' N ' ' O ' ' A' ' 12' ' ' PRO . 10.1 p -62.6 -110.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.952 0.406 . . . . 0.0 111.434 -179.502 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -67.59 23.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.41 -179.633 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -66.04 -26.06 67.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.751 179.736 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -67.38 12.67 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.973 -179.806 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.53 ' H ' ' C ' ' A' ' 16' ' ' CYS . 16.8 mt -162.89 124.34 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.426 -179.862 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.04 107.37 0.35 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 62.3 t-20 -174.56 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.267 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -46.13 -64.66 0.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.355 -179.652 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 t -56.11 -53.52 56.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.274 -179.545 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -51.68 -72.59 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.931 -179.845 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.81 -44.57 28.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.437 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 7.2 m-20 -55.51 -74.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.498 -179.542 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.508 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 0.5 OUTLIER -52.17 -34.09 43.49 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.164 -179.658 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.21 1.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.263 179.34 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.493 ' H ' ' C ' ' A' ' 26' ' ' CYS . 57.9 tp -162.92 -29.82 0.04 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.991 -179.728 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.06 -48.58 57.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.765 0.317 . . . . 0.0 110.692 179.846 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -100.2 18.03 19.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.938 -179.918 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.1 m170 55.43 44.74 26.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 -179.727 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -87.4 -160.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.493 -179.732 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.507 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 40.4 ttm-85 -139.01 -27.3 0.82 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 -179.856 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 1.5 p -178.64 120.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.126 179.712 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -118.91 179.37 16.79 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.363 -179.271 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -178.71 145.71 0.31 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.65 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.93 131.37 34.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.833 0.349 . . . . 0.0 111.181 -179.675 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.438 ' O ' HD12 ' A' ' 45' ' ' LEU . 51.3 m-85 -146.7 171.35 15.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.303 -179.653 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -86.13 134.53 33.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.225 179.318 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 42' ' ' LYS . 2.4 p-10 -142.07 -83.23 0.19 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.19 0.519 . . . . 0.0 112.165 -179.101 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.434 ' H ' ' CG ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -59.72 70.47 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.221 -178.095 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.4 mptt 53.81 85.07 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.536 179.252 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.652 ' H ' ' HE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER 57.92 18.49 5.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.756 179.109 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.479 ' O ' ' OD1' ' A' ' 40' ' ' ASP . 3.3 m120 -93.8 115.75 28.18 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 179.327 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.438 HD12 ' O ' ' A' ' 38' ' ' PHE . 21.2 tp -82.75 93.07 7.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.407 -179.026 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -100.94 -178.92 3.9 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.39 179.87 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -104.79 104.07 13.79 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.491 -179.568 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.821 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.0 OUTLIER -88.65 109.53 20.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.511 179.305 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.0 m -96.95 119.18 34.94 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.774 0.321 . . . . 0.0 111.267 -179.709 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.503 ' CB ' ' O ' ' A' ' 34' ' ' SER . 2.2 t0 -94.48 137.08 34.05 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.185 0.517 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.507 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 5.6 m-85 -103.61 -17.89 14.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.46 179.996 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.0 m -113.49 -116.42 0.32 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.972 -179.59 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 169.26 -58.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.775 -179.99 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.813 -179.882 . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.584 0 CA-C-O 120.801 0.334 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -84.46 -101.89 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.977 -179.95 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 36.9 mttm -48.05 160.65 0.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.144 -179.751 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -8.44 2.3 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.558 179.726 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.41 ' O ' ' CE ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -147.08 145.55 29.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.998 179.972 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HZ1' ' CD ' ' A' ' 9' ' ' GLU . 8.3 tttp -146.73 116.86 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.128 0.49 . . . . 0.0 110.861 -179.777 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -63.25 142.75 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.456 -179.573 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.563 ' C ' ' H ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -62.78 110.95 1.91 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.833 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.455 ' C ' ' OD1' ' A' ' 10' ' ' ASN . 26.7 mt-10 -60.65 5.86 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.398 -178.674 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.563 ' H ' ' C ' ' A' ' 8' ' ' TYR . 1.8 p-10 172.2 122.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.8 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.627 ' O ' ' N ' ' A' ' 13' ' ' VAL . 19.8 t80 -179.72 123.54 0.23 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.089 179.955 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.14 76.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.397 2.065 . . . . 0.0 113.138 -179.634 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.627 ' N ' ' O ' ' A' ' 11' ' ' TYR . 1.4 p -58.68 97.15 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.144 0.497 . . . . 0.0 110.981 179.849 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.533 ' C ' ' H ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -178.0 -57.78 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.778 -179.867 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.553 ' C ' ' H ' ' A' ' 17' ' ' GLN . 13.7 tttp -67.21 10.25 0.17 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.666 179.987 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.533 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -67.61 19.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.233 -179.921 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.688 ' C ' HD12 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -88.33 56.32 3.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 110.875 -179.682 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.688 HD12 ' C ' ' A' ' 17' ' ' GLN . 5.5 mp -161.92 -122.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.671 179.737 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 174.01 28.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 -179.688 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 21' ' ' GLN . 29.1 t-20 -131.19 -52.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.486 179.961 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.42 ' C ' ' O ' ' A' ' 20' ' ' ASN . 11.0 mm100 -37.19 -86.87 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.916 -179.764 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.8 m -59.87 -37.33 79.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.536 0.208 . . . . 0.0 111.326 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.485 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 13.5 t-20 -56.28 -75.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.68 0.276 . . . . 0.0 110.954 179.788 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.512 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -48.86 -43.57 38.93 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.906 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.509 ' O ' ' N ' ' A' ' 29' ' ' ASP . 10.7 m-20 -51.89 -57.36 9.61 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.684 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.3 m -53.62 -44.55 69.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.406 0.622 . . . . 0.0 109.464 178.801 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -62.51 7.51 0.07 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 113.165 -178.78 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.87 -37.65 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.933 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.509 ' N ' ' O ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -66.79 -12.55 59.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.769 0.319 . . . . 0.0 111.081 -179.259 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -144.63 10.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.082 179.768 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.7 m80 54.9 46.8 23.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.555 -179.883 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.6 -174.19 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.382 -179.664 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.401 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 0.9 OUTLIER -96.66 -59.63 1.77 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.229 179.586 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.449 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 3.9 p -158.05 114.05 2.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.694 179.991 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.485 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -105.62 164.26 13.99 Favored Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.142 -179.618 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -176.43 167.66 2.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.982 0.42 . . . . 0.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.4 m -89.29 130.01 35.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.278 -179.716 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -148.22 161.98 40.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.955 179.898 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.58 ' O ' ' N ' ' A' ' 41' ' ' GLU . 75.4 m-85 -91.2 115.28 27.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.816 179.799 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.492 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 6.8 p-10 -57.11 77.12 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.51 0.671 . . . . 0.0 110.492 179.854 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 39' ' ' TYR . 34.4 mt-10 27.87 40.57 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.688 -1.142 . . . . 0.0 112.177 -179.724 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -142.23 -81.83 0.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.099 178.807 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 10.1 mtp180 160.74 23.73 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.97 179.789 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.474 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 98.9 m-20 -97.65 -13.61 21.42 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.591 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.514 HD13 ' CZ ' ' A' ' 39' ' ' TYR . 5.9 tp 57.68 122.19 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.644 0.259 . . . . 0.0 111.15 -179.665 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.474 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -149.54 -179.14 6.86 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.423 179.107 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.524 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 36.3 m -102.07 139.14 38.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 14.5 mt -139.4 121.21 16.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 0.0 112.052 -178.884 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 m -92.63 124.11 36.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.018 178.468 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' A' ' 34' ' ' SER . 9.0 t70 -88.49 124.38 33.93 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.126 0.489 . . . . 0.0 111.192 -179.319 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -115.18 50.2 1.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.311 -179.383 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 69.4 m -87.75 28.24 1.04 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.542 179.916 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' A' ' 54' ' ' TYR . 5.4 tm-20 -49.86 122.01 6.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.607 179.549 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.463 ' O ' ' OE1' ' A' ' 53' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.852 -179.724 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 1' ' ' PCA . . . . . 0.464 ' C ' ' H ' ' A' ' 3' ' ' LYS . . . . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 120.937 0.399 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.483 ' O ' ' CB ' ' A' ' 3' ' ' LYS . 4.5 t70 73.76 -14.44 0.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.694 -179.683 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.483 ' CB ' ' O ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER 84.08 86.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.068 179.844 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 68.6 m 53.22 39.18 29.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.105 179.752 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 135.5 26.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.436 179.924 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -149.79 121.87 8.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.913 0.387 . . . . 0.0 111.285 179.829 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -61.85 161.98 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.179 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.233 179.782 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.424 ' CD1' ' HB2' ' A' ' 11' ' ' TYR . 0.2 OUTLIER -113.15 84.49 2.01 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.473 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -57.94 -79.62 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.146 -178.174 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.604 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 63.8 t30 -38.96 -38.88 0.48 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.696 -178.416 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' HB2' ' CD1' ' A' ' 8' ' ' TYR . 53.0 t80 -52.87 124.84 37.56 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.585 -178.939 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.562 ' C ' ' H ' ' A' ' 14' ' ' SER . 73.0 Cg_exo -46.35 112.32 0.45 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 122.148 1.898 . . . . 0.0 112.579 179.567 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.3 p -60.59 7.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.477 179.598 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.562 ' H ' ' C ' ' A' ' 12' ' ' PRO . 5.1 p -60.66 -108.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.558 -179.252 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 ttpm? -63.44 149.74 45.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 -179.527 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -171.94 3.92 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.608 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -86.62 -32.24 20.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.978 -179.892 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.576 ' C ' ' H ' ' A' ' 20' ' ' ASN . 1.3 mm? -68.86 116.26 9.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.726 -179.415 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.19 39.06 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.076 179.161 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.576 ' H ' ' C ' ' A' ' 18' ' ' LEU . 1.7 t-20 -136.71 -108.04 0.2 Allowed 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.941 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.555 ' C ' ' O ' ' A' ' 20' ' ' ASN . 4.9 mm-40 0.9 -80.59 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.069 0.547 . . . . 0.0 112.439 179.182 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.0 t -58.01 -58.07 10.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.889 179.848 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 20' ' ' ASN . 19.3 t-20 -52.83 -56.96 11.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.459 179.957 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -53.14 -52.52 58.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.352 179.46 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.8 m-20 -50.99 -50.16 58.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.29 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.496 ' C ' ' H ' ' A' ' 28' ' ' LEU . 1.2 m -51.83 -54.26 30.96 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.447 0.641 . . . . 0.0 109.331 178.696 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -61.25 14.75 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.683 -179.806 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.54 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -167.2 -53.63 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.378 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -65.81 -13.26 59.15 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.569 0.223 . . . . 0.0 111.483 -178.884 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 31' ' ' HIS . 3.0 mmmp? -139.79 24.02 2.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.009 0.433 . . . . 0.0 110.776 179.875 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.441 ' C ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 34.0 38.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.089 179.636 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.76 179.99 6.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.909 0.385 . . . . 0.0 110.937 179.923 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 mmm-85 -92.27 -27.19 17.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.266 0.555 . . . . 0.0 109.837 179.724 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.6 p 178.37 -168.09 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.836 179.629 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.41 -177.16 47.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.352 179.975 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.45 -154.42 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -179.836 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.94 142.86 30.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.733 0.301 . . . . 0.0 110.574 179.493 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.492 ' O ' HD12 ' A' ' 45' ' ' LEU . 66.5 m-85 -146.88 164.41 32.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.124 0.487 . . . . 0.0 111.585 -179.41 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.405 ' CE2' HD13 ' A' ' 45' ' ' LEU . 22.2 m-85 -101.59 119.3 38.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.078 -179.8 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.591 ' C ' ' H ' ' A' ' 42' ' ' LYS . 11.4 p-10 -51.75 168.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.623 179.703 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -64.22 36.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.495 -179.835 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 40' ' ' ASP . 3.6 mmtp -146.86 -81.25 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.171 179.625 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -176.82 20.7 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.112 179.677 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.78 124.66 46.75 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.65 179.527 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 38' ' ' PHE . 51.6 tp -89.51 138.48 31.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.389 179.424 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -147.61 145.8 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 111.63 -179.459 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -82.67 109.02 16.48 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.929 -179.96 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.9 mt -90.3 116.88 32.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.912 0.387 . . . . 0.0 111.86 -179.925 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.47 120.1 36.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.685 179.412 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.28 136.28 34.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.958 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -111.16 -6.34 14.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.598 -179.29 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.7 m -143.48 -113.65 0.11 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.035 0.445 . . . . 0.0 111.822 -179.294 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 67.8 127.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.855 -179.372 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.643 179.868 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 120.855 0.36 . . . . 0.0 110.692 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.67 122.48 13.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.752 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.93 125.48 45.94 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.436 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.573 ' O ' ' N ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -67.07 127.86 29.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.32 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.535 ' O ' ' C ' ' A' ' 9' ' ' GLU . 2.9 t80 -61.25 73.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 7' ' ' VAL . 15.0 mp0 16.36 -125.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.67 0.606 . . . . 0.0 111.139 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 57.8 t-20 -57.21 -122.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 6.5 t80 97.64 95.67 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.609 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.24 115.47 1.75 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 121.786 1.658 . . . . 0.0 111.486 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 15' ' ' LYS . 68.0 t -50.69 -50.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.884 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 69.6 p 19.12 -79.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.502 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 13' ' ' VAL . 21.3 tptp -65.44 -87.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.155 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.468 ' C ' ' O ' ' A' ' 15' ' ' LYS . 2.2 m 28.1 81.3 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 121.021 0.438 . . . . 0.0 111.625 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -142.26 -23.73 0.67 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.689 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.425 ' O ' ' O ' ' A' ' 19' ' ' ALA . 1.4 mt -165.17 -176.41 4.08 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.366 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -54.73 -157.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.118 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 21' ' ' GLN . 30.9 t30 76.38 -87.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.104 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.448 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -30.29 -90.37 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.729 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.6 m -55.68 -45.42 77.79 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -51.83 -71.74 0.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.428 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -49.91 -59.52 3.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.359 -179.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.9 m-20 -49.17 -54.75 14.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.505 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.0 m -54.74 -41.98 71.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -62.14 10.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.012 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.672 ' O ' HD23 ' A' ' 28' ' ' LEU . 6.0 tt -165.49 -45.52 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.615 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 9.9 m-20 -67.16 -15.26 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.082 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -141.37 30.07 1.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.0 0.428 . . . . 0.0 110.808 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.453 ' C ' ' O ' ' A' ' 30' ' ' LYS . 4.5 m80 32.42 39.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.242 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 30' ' ' LYS . . . -87.69 -176.64 5.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.827 0.346 . . . . 0.0 111.037 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.96 -38.28 11.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.328 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -163.61 -157.08 0.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.401 179.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.519 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 163.07 169.21 26.17 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.143 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -178.05 170.2 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 55.4 m -86.7 127.39 34.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.767 0.318 . . . . 0.0 110.484 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.41 ' HB2' HD13 ' A' ' 48' ' ' ILE . 39.2 m-85 -142.12 165.98 25.95 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.373 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.475 ' HB2' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -145.1 -178.1 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.856 179.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -121.79 -178.29 3.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.072 -179.906 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.32 42.97 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.399 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.539 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER -138.44 -25.29 0.93 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.932 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.539 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 2.2 tpt180 89.63 61.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.27 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 43' ' ' ARG . 4.9 m-20 -142.87 105.73 4.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.583 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.484 ' O ' HG22 ' A' ' 13' ' ' VAL . 35.8 mt -86.57 136.2 33.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.543 0.687 . . . . 0.0 112.566 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.494 ' O ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -145.67 153.87 41.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.22 179.4 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.535 ' SG ' ' CZ ' ' A' ' 11' ' ' TYR . 1.8 m -75.89 101.37 5.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.368 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 46' ' ' GLN . 2.1 mp -89.27 121.7 39.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.796 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.3 m -95.64 117.3 30.21 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.52 133.86 34.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.0 0.429 . . . . 0.0 111.542 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -103.63 -25.71 13.07 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.18 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 120.952 0.406 . . . . 0.0 111.159 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.531 0.234 0 CA-C-O 120.517 0.198 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -95.81 139.46 32.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.998 0.427 . . . . 0.0 111.275 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -140.39 101.83 4.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.818 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.442 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -61.8 130.39 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.814 -178.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.477 ' O ' ' C ' ' A' ' 9' ' ' GLU . 1.1 t80 -72.66 67.33 0.77 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.477 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.0 mt-10 32.11 -149.7 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.302 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.587 ' CG ' ' H ' ' A' ' 11' ' ' TYR . 9.3 p30 -50.9 -67.33 0.26 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.401 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.587 ' H ' ' CG ' ' A' ' 10' ' ' ASN . 23.4 t80 99.4 128.72 0.02 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 C-N-CA 123.306 0.643 . . . . 0.0 110.585 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.714 ' O ' HG23 ' A' ' 13' ' ' VAL . 72.6 Cg_exo -44.92 -69.16 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 121.353 1.369 . . . . 0.0 111.759 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.779 ' O ' HG12 ' A' ' 13' ' ' VAL . 66.2 t 110.44 18.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.801 1.313 . . . . 0.0 110.148 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.29 -21.52 65.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.639 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.94 141.04 0.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.923 0.392 . . . . 0.0 111.098 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -176.65 58.67 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.467 0.651 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.496 ' C ' HD12 ' A' ' 18' ' ' LEU . 95.1 mm-40 -106.58 -22.72 12.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.704 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.496 HD12 ' C ' ' A' ' 17' ' ' GLN . 3.6 mp -163.38 170.47 17.46 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.466 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 113.02 1.51 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.668 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -178.77 -95.9 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.172 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -46.11 -53.63 9.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.888 0.375 . . . . 0.0 110.319 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.1 t -60.55 -55.91 27.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.741 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -52.95 -65.98 0.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.468 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.531 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.29 -47.28 36.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.616 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.5 m-20 -53.55 -62.21 1.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.76 0.314 . . . . 0.0 110.531 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.48 ' C ' ' H ' ' A' ' 28' ' ' LEU . 99.3 m -54.4 -41.02 68.8 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.135 0.493 . . . . 0.0 109.968 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 5.24 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.917 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.48 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.4 tp -163.22 -47.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.375 -0.53 . . . . 0.0 112.256 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.616 ' N ' ' O ' ' A' ' 25' ' ' ASP . 72.9 m-20 -66.01 -10.95 44.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.241 0.543 . . . . 0.0 109.655 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 31' ' ' HIS . 4.2 tptt -143.33 9.79 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.067 179.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.43 ' C ' ' O ' ' A' ' 30' ' ' LYS . 3.3 p80 35.2 43.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.83 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.43 -166.21 1.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.835 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -33.95 11.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.626 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -174.06 -154.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.701 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.46 ' C ' ' OE1' ' A' ' 36' ' ' GLU . . . 152.73 179.65 28.45 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.532 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.46 ' OE1' ' C ' ' A' ' 35' ' ' GLY . 6.7 pm0 -177.53 175.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.671 -0.265 . . . . 0.0 110.307 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.09 148.94 22.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 0.0 111.4 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -146.61 146.02 30.28 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.434 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.483 ' CE1' HD22 ' A' ' 45' ' ' LEU . 11.2 m-85 -76.87 151.44 35.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.103 0.478 . . . . 0.0 111.867 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -101.33 -179.89 4.16 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.759 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -64.7 -7.84 12.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.077 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.32 -80.4 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.08 32.68 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.75 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -128.87 144.53 51.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.82 0.343 . . . . 0.0 111.044 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.483 HD22 ' CE1' ' A' ' 39' ' ' TYR . 0.1 OUTLIER -90.74 148.06 22.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.126 0.489 . . . . 0.0 111.162 -179.802 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -141.78 147.51 37.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.061 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.691 ' C ' HD12 ' A' ' 48' ' ' ILE . 0.8 OUTLIER -70.9 143.21 51.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 112.127 -179.214 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.691 HD12 ' C ' ' A' ' 47' ' ' CYS . 2.0 mp -136.1 115.23 16.12 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.128 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.3 m -91.85 124.71 36.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.493 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -92.98 127.69 38.58 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.878 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -104.52 -3.33 24.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.135 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.466 0.334 0 CA-C-O 120.973 0.416 . . . . 0.0 111.06 179.9 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 111.331 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.416 ' HB3' ' HZ2' ' A' ' 5' ' ' LYS . 0.6 OUTLIER -90.23 136.49 33.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.428 -178.829 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -149.9 123.53 9.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.986 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.64 145.1 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.351 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.562 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.2 t80 -92.29 74.5 5.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.818 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.562 ' O ' ' O ' ' A' ' 8' ' ' TYR . 25.8 mt-10 21.12 110.15 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.789 0.681 . . . . 0.0 112.72 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.503 ' C ' ' O ' ' A' ' 9' ' ' GLU . 3.9 t30 15.67 56.94 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.204 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.646 ' CD2' ' SG ' ' A' ' 47' ' ' CYS . 87.4 t80 -54.13 110.15 1.94 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.023 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.606 ' O ' ' N ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.05 117.2 1.77 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.833 1.689 . . . . 0.0 112.148 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.406 ' H ' HG23 ' A' ' 13' ' ' VAL . 2.4 t -60.2 41.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.065 -179.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.606 ' N ' ' O ' ' A' ' 12' ' ' PRO . 25.2 p -63.68 -32.3 73.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.862 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -172.56 141.52 1.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.294 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -173.09 0.07 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -87.49 46.73 1.41 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.532 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 1.8 mt -167.48 -95.85 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.262 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 170.81 -165.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.827 0.346 . . . . 0.0 110.146 -178.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.584 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.7 t30 60.6 -74.55 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.515 ' N ' ' O ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -35.62 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 109.969 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.71 -45.44 92.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.449 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -76.2 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.088 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.584 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -42.3 -41.01 2.64 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.634 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.489 ' O ' ' N ' ' A' ' 29' ' ' ASP . 1.2 m-20 -52.88 -61.51 2.25 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.481 ' C ' ' H ' ' A' ' 28' ' ' LEU . 73.4 m -51.79 -47.33 64.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.501 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -61.18 12.22 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.674 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.8 tt -166.6 -37.88 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -66.62 -14.57 62.59 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.692 -179.378 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -143.2 3.55 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.2 m170 63.51 43.35 5.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.723 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.677 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -88.48 -178.55 5.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.011 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.435 ' HE ' ' C ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -92.82 -35.09 13.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.321 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.7 p -172.37 -159.59 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.928 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.17 175.59 23.96 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.83 -1.176 . . . . 0.0 113.524 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG3' ' CE2' ' A' ' 38' ' ' PHE . 3.1 pt-20 -178.59 165.97 1.73 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.502 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.7 OUTLIER -88.16 146.62 25.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.011 0.434 . . . . 0.0 111.514 -179.159 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CE2' ' HG3' ' A' ' 36' ' ' GLU . 33.8 m-85 -144.84 160.03 41.94 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.312 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 40' ' ' ASP . 7.6 m-85 -94.38 86.62 4.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.717 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -42.34 167.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.776 0.322 . . . . 0.0 110.342 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.01 -0.32 0.68 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.93 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -110.46 17.63 20.6 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? 60.62 61.45 1.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.156 0.503 . . . . 0.0 110.595 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.483 ' O ' ' OD1' ' A' ' 40' ' ' ASP . 87.4 m-20 -147.12 129.74 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.681 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 39' ' ' TYR . 4.7 mt -85.43 100.73 12.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.423 ' OE1' ' OD2' ' A' ' 40' ' ' ASP . 20.3 mt-30 -113.53 145.96 40.39 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.467 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.1 m -82.5 101.49 10.74 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.982 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 mp -88.42 111.77 22.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 82.7 m -93.85 125.3 38.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.266 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.677 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 65.3 t0 -95.19 140.74 29.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.959 0.409 . . . . 0.0 110.91 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.51 ' CE2' ' HB2' ' A' ' 32' ' ' ALA . 55.8 m-85 -128.91 66.8 1.42 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.323 -178.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.435 ' C ' ' HE ' ' A' ' 33' ' ' ARG . 72.7 m . . . . . 0 C--N 1.328 -0.352 0 CA-C-O 121.048 0.451 . . . . 0.0 110.875 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.503 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.7 m . . . . . 0 CA--C 1.533 0.289 0 CA-C-O 120.77 0.319 . . . . 0.0 111.234 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.95 136.48 24.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 111.068 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -151.83 133.19 14.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.142 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.407 HG13 ' H ' ' A' ' 7' ' ' VAL . 1.4 m -65.72 152.56 9.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.367 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.446 ' C ' ' CD1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER -94.47 98.08 10.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.552 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -66.28 116.03 6.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.581 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.409 ' HB2' ' CE1' ' A' ' 8' ' ' TYR . 28.5 t-20 -178.45 -98.58 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.136 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.8 149.79 15.81 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.583 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.495 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 72.3 Cg_endo -75.16 10.91 1.62 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.464 2.109 . . . . 0.0 111.721 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.721 ' O ' HG12 ' A' ' 13' ' ' VAL . 97.8 t 102.06 2.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 124.72 1.262 . . . . 0.0 110.586 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.554 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 24.8 p -60.73 -75.08 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.554 ' N ' ' OG ' ' A' ' 14' ' ' SER . 29.6 mttm -66.96 102.58 1.0 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.225 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -172.37 28.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.416 -179.423 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -115.12 37.8 3.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.255 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 20' ' ' ASN . 0.5 OUTLIER -169.37 119.16 0.67 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.792 0.33 . . . . 0.0 111.159 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.23 52.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.165 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -140.87 -82.37 0.23 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.725 0.298 . . . . 0.0 111.24 -179.434 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 4.3 tp-100 -38.19 -61.69 0.64 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.911 0.386 . . . . 0.0 110.826 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.81 -54.62 39.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.251 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.45 -64.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.792 0.329 . . . . 0.0 110.247 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 0.4 OUTLIER -50.64 -39.76 51.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.89 179.238 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.1 m-20 -55.36 -58.5 7.47 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.464 ' C ' ' H ' ' A' ' 28' ' ' LEU . 61.7 m -52.39 -43.55 64.82 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -59.62 7.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.583 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.7 tp -166.35 -37.02 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.515 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.5 m-20 -66.16 -13.27 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.371 . . . . 0.0 110.739 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -142.34 0.4 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.1 m80 64.33 45.43 3.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.945 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.75 -178.46 5.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.255 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.64 -32.01 12.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.305 0.574 . . . . 0.0 110.065 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.2 p 178.07 146.12 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.536 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.94 -177.16 23.7 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.845 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -178.62 168.63 1.75 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 0.0 110.918 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.8 m -88.8 132.22 34.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.437 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -143.79 164.83 29.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.534 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -91.41 104.52 17.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.996 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.529 ' C ' ' H ' ' A' ' 42' ' ' LYS . 8.9 p-10 -92.34 -177.48 4.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.041 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -63.29 39.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.616 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 21.11 1.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.869 0.366 . . . . 0.0 110.612 179.665 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 40.54 39.83 0.8 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.159 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -144.49 159.8 42.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.569 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.573 ' O ' HG13 ' A' ' 13' ' ' VAL . 9.6 mt -85.4 94.98 9.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.688 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -90.47 139.94 30.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.396 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -83.8 93.77 8.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.9 mt -83.47 118.04 30.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.931 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 8' ' ' TYR . 39.7 m -97.61 112.98 24.63 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.392 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -95.15 132.33 40.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 110.666 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.31 -42.69 7.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.548 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.503 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 23.0 m . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.652 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.173 0 CA-C-O 120.575 0.226 . . . . 0.0 111.11 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.85 135.57 35.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.99 0.424 . . . . 0.0 111.235 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -147.89 130.52 15.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.104 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -64.44 127.68 25.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.502 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.607 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 28.8 t80 -74.56 2.55 9.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.253 0.549 . . . . 0.0 110.527 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.56 ' O ' ' C ' ' A' ' 10' ' ' ASN . 9.9 pt-20 32.54 -154.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.676 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.56 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 11.89 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.457 0.473 . . . . 0.0 111.676 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.438 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 4.6 t80 -176.81 133.23 0.38 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.099 -179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.586 ' O ' ' N ' ' A' ' 14' ' ' SER . 61.0 Cg_endo -71.0 47.28 0.73 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.128 1.885 . . . . 0.0 112.135 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.515 ' C ' ' O ' ' A' ' 12' ' ' PRO . 2.8 t 12.02 54.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.713 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 12' ' ' PRO . 74.8 p -63.58 -125.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.7 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 32.4 mttm -67.45 161.28 25.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.64 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 1.3 m -173.42 93.89 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.386 0.613 . . . . 0.0 111.34 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.475 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER 156.46 -48.02 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.782 -1.099 . . . . 0.0 108.888 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.6 mt -75.59 125.47 29.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.732 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.86 92.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.367 . . . . 0.0 110.672 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.551 ' CG ' ' H ' ' A' ' 21' ' ' GLN . 19.4 t-20 -173.43 -121.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.551 ' H ' ' CG ' ' A' ' 20' ' ' ASN . 14.3 mm-40 -5.17 -79.45 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.918 0.761 . . . . 0.0 112.412 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -55.72 31.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.447 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 20' ' ' ASN . 4.4 t-20 -53.13 -61.62 2.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.346 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.74 -57.62 8.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -50.1 -53.67 25.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.218 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.653 ' C ' ' H ' ' A' ' 28' ' ' LEU . 84.0 m -57.69 -47.13 83.21 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.24 11.0 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.119 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.678 ' O ' ' N ' ' A' ' 30' ' ' LYS . 9.1 tp -161.14 -137.5 0.04 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 52.25 -78.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.678 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -101.32 -4.6 26.74 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 177.631 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.461 ' CD2' ' C ' ' A' ' 30' ' ' LYS . 10.5 m-70 70.19 65.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.263 178.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.21 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.264 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.498 HH21 ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.08 -34.03 10.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.293 0.568 . . . . 0.0 109.654 179.472 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.498 ' CB ' HH21 ' A' ' 33' ' ' ARG . 96.5 p -176.51 -169.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.035 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -153.76 174.12 32.36 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.108 -1.044 . . . . 0.0 113.349 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.86 143.51 0.43 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.519 ' HB3' HD22 ' A' ' 45' ' ' LEU . 99.5 m -90.05 157.18 17.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.062 0.458 . . . . 0.0 111.985 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -147.24 142.28 27.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.851 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -86.29 173.19 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 111.618 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.584 ' C ' ' H ' ' A' ' 42' ' ' LYS . 29.1 p-10 -118.89 178.88 4.32 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.737 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.67 25.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.959 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.584 ' H ' ' C ' ' A' ' 40' ' ' ASP . 14.3 tppt? -145.26 -77.78 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.968 0.413 . . . . 0.0 109.932 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.614 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -179.12 12.57 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.29 179.762 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.433 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 0.6 OUTLIER -90.7 133.51 35.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.942 0.401 . . . . 0.0 110.673 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.519 HD22 ' HB3' ' A' ' 37' ' ' CYS . 6.4 mt -90.93 160.27 15.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -141.96 136.01 29.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.038 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.93 100.42 12.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.471 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.461 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.2 mp -89.62 116.41 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.594 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -94.78 119.26 33.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.652 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -94.07 123.17 37.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.571 0.7 . . . . 0.0 111.876 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.41 ' O ' ' HB2' ' A' ' 33' ' ' ARG . 11.8 m-85 -97.31 -94.43 0.22 Allowed 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.563 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.007 178.942 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.08 126.96 11.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.883 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.57 137.24 16.94 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.486 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.64 146.65 11.82 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.155 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.492 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.5 t80 -73.36 -16.12 61.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.361 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.642 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 88.23 143.34 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.643 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.493 ' C ' ' O ' ' A' ' 9' ' ' GLU . 13.6 t-20 15.33 46.61 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.926 0.766 . . . . 0.0 112.508 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.642 ' N ' ' O ' ' A' ' 9' ' ' GLU . 39.0 t80 -59.05 122.6 64.17 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.892 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -41.43 86.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.944 1.763 . . . . 0.0 112.031 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.55 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -53.17 97.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.039 0.447 . . . . 0.0 111.392 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -177.59 -82.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.333 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -68.71 99.33 1.0 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.601 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.552 ' HB3' HD12 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -172.59 105.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.494 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 169.37 36.11 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -166.6 145.29 5.44 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.887 0.375 . . . . 0.0 111.103 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.63 55.32 0.01 OUTLIER 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.237 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.601 ' N ' ' O ' ' A' ' 18' ' ' LEU . 7.1 t-20 -148.75 -115.06 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.604 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.554 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.2 mp0 3.41 -79.76 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 123.74 0.65 . . . . 0.0 112.241 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -56.11 26.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.928 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -53.12 -61.26 2.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.319 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.537 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.45 -54.52 26.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.363 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.0 m-20 -51.35 -66.42 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.315 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.537 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.6 m -47.23 -43.92 22.24 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.94 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -59.48 8.71 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.924 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.9 tp -164.28 -36.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.942 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.482 ' N ' ' O ' ' A' ' 25' ' ' ASP . 15.4 m-20 -70.23 -21.42 63.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.862 0.363 . . . . 0.0 110.875 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' CG ' ' OH ' ' A' ' 51' ' ' TYR . 3.8 tptp -136.11 5.69 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.061 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.53 31.91 20.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.795 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.695 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.33 -177.73 6.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.93 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -99.08 -23.88 15.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.637 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.446 ' CB ' HD21 ' A' ' 23' ' ' ASN . 1.7 p -175.06 -165.32 0.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.864 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.53 -175.7 46.57 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.55 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -175.96 146.44 0.7 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.928 0.394 . . . . 0.0 111.316 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.24 105.83 18.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.462 ' CD2' HD12 ' A' ' 48' ' ' ILE . 41.0 m-85 -99.85 125.19 45.77 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.003 0.43 . . . . 0.0 112.082 -179.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.615 ' CE1' HD22 ' A' ' 45' ' ' LEU . 74.6 m-85 -73.98 174.36 8.7 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.103 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 3.0 p30 -173.52 156.15 2.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.748 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.478 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.2 pt-20 16.45 -74.53 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.872 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -99.09 45.43 1.0 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.382 -179.148 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.572 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 23.5 66.0 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.808 179.612 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.91 ' C ' HD23 ' A' ' 45' ' ' LEU . 0.6 OUTLIER -97.75 -3.76 38.42 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.91 HD23 ' C ' ' A' ' 44' ' ' ASN . 1.2 pt? 36.74 93.83 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.21 0.529 . . . . 0.0 112.018 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mp0 -94.12 138.11 32.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.803 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.449 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -77.0 98.11 4.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.809 -178.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.462 HD12 ' CD2' ' A' ' 38' ' ' PHE . 5.5 mt -86.51 114.56 26.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.708 179.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 65.6 m -91.31 117.73 29.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.467 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.695 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 6.6 t70 -95.26 127.83 41.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.0 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.454 ' OH ' ' CG ' ' A' ' 30' ' ' LYS . 39.4 m-85 -97.47 4.82 50.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.727 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.4 m . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.408 . . . . 0.0 110.435 179.465 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.14 0 CA-C-O 120.881 0.372 . . . . 0.0 110.767 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.8 141.04 27.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.976 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 134.68 24.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.958 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -61.48 131.67 26.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.681 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.6 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -67.14 -3.03 6.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.498 ' O ' ' O ' ' A' ' 10' ' ' ASN . 4.9 mt-10 90.46 -123.41 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.905 0.753 . . . . 0.0 110.398 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.569 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 10.5 m120 -53.47 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.269 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.569 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 24.1 t80 102.29 137.94 0.01 OUTLIER Pre-proline 0 N--CA 1.47 0.55 0 O-C-N 123.73 0.644 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.58 83.95 1.66 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.096 1.864 . . . . 0.0 112.226 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.435 ' CG1' HD23 ' A' ' 45' ' ' LEU . 3.0 t -52.61 106.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.002 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.6 p -173.51 -80.17 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.928 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -65.99 -17.79 64.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.911 0.386 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.497 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -65.15 84.07 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.46 179.832 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.2 mm-40 -132.85 -11.39 3.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.316 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.8 mt -165.48 167.08 17.87 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.935 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.541 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -57.28 137.1 56.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.58 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.554 ' CG ' ' N ' ' A' ' 21' ' ' GLN . 1.6 t-20 150.45 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.257 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.554 ' N ' ' CG ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -50.03 -55.18 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.217 179.847 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.0 t -59.45 -54.62 44.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.455 HD22 ' C ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER -52.11 -67.84 0.22 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.762 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.558 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.11 -46.65 53.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.963 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.1 m-20 -49.2 -61.24 2.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.533 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.497 ' C ' ' H ' ' A' ' 28' ' ' LEU . 92.2 m -55.03 -42.73 72.98 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.587 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -60.17 7.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.323 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.2 tp -164.42 -20.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 25' ' ' ASP . 2.0 m-20 -68.27 -64.52 0.85 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.781 0.324 . . . . 0.0 110.648 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mttp -101.06 12.66 37.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.65 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.8 m170 68.3 39.35 2.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.194 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -87.72 -177.04 5.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.907 0.384 . . . . 0.0 111.323 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.67 -37.74 11.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.502 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.582 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.7 p -177.64 -140.33 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.627 0.251 . . . . 0.0 110.786 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.582 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 124.53 -159.31 19.16 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.727 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.77 171.8 2.18 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.35 131.83 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 111.567 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.502 ' O ' HD12 ' A' ' 45' ' ' LEU . 70.4 m-85 -149.42 -171.19 3.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.241 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.595 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 6.6 m-85 -90.65 141.61 28.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.944 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.572 ' C ' ' H ' ' A' ' 42' ' ' LYS . 1.3 p-10 -99.3 171.2 8.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.356 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -64.19 36.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.382 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.572 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.6 OUTLIER -143.01 8.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.057 0.456 . . . . 0.0 110.316 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' C ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 59.93 58.86 2.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.571 -179.726 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 2.3 m120 -143.82 -138.18 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.056 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 38' ' ' PHE . 27.0 tp -155.12 129.25 8.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.88 0.372 . . . . 0.0 111.414 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.484 ' OE1' ' O ' ' A' ' 45' ' ' LEU . 1.0 OUTLIER -145.76 175.81 10.12 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.214 0.531 . . . . 0.0 111.105 -179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.414 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -95.25 103.47 15.33 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.092 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.3 mm -83.2 113.1 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 111.011 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -95.91 125.42 40.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.433 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.57 ' OD1' ' N ' ' A' ' 51' ' ' TYR . 61.5 t0 -94.29 143.09 26.69 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.503 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.57 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 81.7 m-85 -129.32 31.33 4.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.302 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.5 m . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.891 0.376 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -138.76 127.37 23.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.194 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -144.87 110.02 5.15 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.101 0.477 . . . . 0.0 111.417 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.5 m -69.36 143.49 14.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.522 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.517 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.7 OUTLIER -89.86 71.76 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.002 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.94 71.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.321 -178.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.531 ' O ' ' C ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER 177.94 -79.16 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.536 179.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.548 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.3 t80 -0.42 114.4 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.448 0 O-C-N 123.915 0.759 . . . . 0.0 112.438 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.431 ' O ' ' N ' ' A' ' 14' ' ' SER . 86.8 Cg_exo -44.11 98.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.442 ' H ' HG23 ' A' ' 13' ' ' VAL . 2.0 t -54.29 87.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.933 0.396 . . . . 0.0 111.131 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.453 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 1.7 p -176.2 139.44 0.36 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.557 ' C ' ' H ' ' A' ' 17' ' ' GLN . 0.5 OUTLIER 84.2 8.54 0.52 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -67.95 21.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.814 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.557 ' H ' ' C ' ' A' ' 15' ' ' LYS . 1.6 mp0 -94.93 18.27 12.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 mt -166.96 147.03 5.56 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.012 0.434 . . . . 0.0 111.18 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.444 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.52 -178.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.967 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.615 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.5 OUTLIER 80.22 -72.42 0.07 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.757 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.7 OUTLIER -54.91 77.07 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.359 179.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ASN . 66.8 m 125.98 -54.29 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.601 1.16 . . . . 0.0 109.04 -178.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -55.16 -54.91 37.24 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.453 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -56.18 -53.86 52.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.977 178.66 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -46.73 -51.84 15.28 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.731 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.914 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 55.6 m -59.31 -43.45 92.65 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -58.08 4.16 0.02 OUTLIER 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.583 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.645 ' O ' ' N ' ' A' ' 30' ' ' LYS . 6.7 tp -164.8 -124.99 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.075 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 36.88 -81.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.73 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.645 ' N ' ' O ' ' A' ' 28' ' ' LEU . 2.2 mptp? -92.78 14.92 15.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.936 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.582 ' N ' ' O ' ' A' ' 28' ' ' LEU . 22.3 m170 62.97 49.71 3.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.862 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.914 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -90.37 -173.29 3.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.83 0.348 . . . . 0.0 110.586 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -114.3 -31.77 6.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.828 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.9 p -165.99 -168.11 1.2 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.41 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . 160.68 175.22 31.45 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.353 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -176.77 176.38 1.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 111.007 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.0 m -88.27 136.92 32.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.856 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -143.19 131.22 21.75 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.843 0.354 . . . . 0.0 111.664 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.571 ' CZ ' HD22 ' A' ' 45' ' ' LEU . 10.2 m-85 -72.42 166.82 21.82 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.476 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.405 ' OD1' ' N ' ' A' ' 44' ' ' ASN . 1.3 p30 -139.99 179.27 6.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.99 -14.78 51.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.49 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.95 5.98 49.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.988 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 18.6 ttp180 62.65 53.72 2.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.722 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.405 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 10.0 m-80 -143.95 135.55 26.04 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.962 ' H ' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -92.1 104.85 17.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.09 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 137.86 32.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.561 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 21.1 m -82.53 104.51 12.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.105 0.478 . . . . 0.0 110.884 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.41 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 17.1 mt -87.03 124.4 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.779 -178.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -98.37 113.84 25.96 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.944 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -93.45 154.93 17.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.013 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.6 -33.4 2.54 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.15 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.33 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.293 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.429 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 2.1 m . . . . . 0 CA--C 1.528 0.099 0 N-CA-C 111.583 0.216 . . . . 0.0 111.583 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -93.68 133.22 37.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.554 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.16 127.34 13.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 111.074 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.4 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.8 OUTLIER -66.58 146.04 13.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.9 OUTLIER -70.51 90.53 0.74 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.62 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -62.29 74.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.241 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.62 ' ND2' ' O ' ' A' ' 9' ' ' GLU . 20.2 p30 125.15 118.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.728 1.211 . . . . 0.0 109.968 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 42.1 t80 178.56 140.22 0.26 Allowed Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.318 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.7 73.66 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.145 1.897 . . . . 0.0 112.43 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.42 ' H ' HG23 ' A' ' 13' ' ' VAL . 3.0 t -55.38 99.75 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.874 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.0 p -175.89 -66.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.914 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -65.57 -3.92 5.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.967 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.42 83.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.107 0.48 . . . . 0.0 110.631 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.652 ' H ' HD12 ' A' ' 18' ' ' LEU . 40.1 mt-30 -145.87 22.78 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.296 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.887 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -164.42 129.73 2.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.076 0.465 . . . . 0.0 110.447 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.27 74.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.905 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.607 ' O ' ' N ' ' A' ' 23' ' ' ASN . 12.5 t-20 -162.39 -113.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.526 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.556 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -3.18 -78.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.719 0.637 . . . . 0.0 112.098 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.6 t -58.89 -54.35 48.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 110.786 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' ASN . 60.3 t30 -52.17 -64.85 0.68 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.232 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.479 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.54 -41.9 61.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.257 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.441 ' OD1' ' O ' ' A' ' 21' ' ' GLN . 1.5 m-20 -54.39 -71.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.13 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.458 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -51.97 -32.18 32.32 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.248 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -59.57 0.2 0.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.396 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.458 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.8 tt -164.93 -26.72 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.717 0.294 . . . . 0.0 111.667 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -69.37 -52.59 25.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 110.822 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.88 11.72 34.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.492 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.8 m170 62.11 33.22 17.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.886 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.2 -179.79 6.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -29.59 13.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 110.398 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.5 p -179.13 -169.94 0.16 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.141 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 169.13 179.77 41.33 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.334 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -175.68 153.62 1.45 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -88.67 137.06 32.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.838 0.352 . . . . 0.0 111.212 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -147.56 152.45 37.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.45 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -57.08 -173.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.855 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 26.4 p-10 -170.75 85.07 0.1 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 40' ' ' ASP . 4.8 pt-20 30.56 27.8 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.821 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 1.5 mtpt -148.59 6.11 0.72 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.727 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 66.55 -2.82 0.97 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.128 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 42' ' ' LYS . 7.8 m-80 -95.42 140.34 30.43 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.718 ' N ' HD12 ' A' ' 45' ' ' LEU . 2.3 mp -78.97 155.42 28.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.666 0.745 . . . . 0.0 112.778 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.433 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -142.95 132.95 24.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.105 179.2 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.7 m -75.52 98.57 3.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.512 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.8 mp -86.66 107.39 16.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.36 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.3 m -97.97 119.19 36.15 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.819 0.343 . . . . 0.0 111.278 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -93.86 129.91 40.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -95.59 -32.65 12.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.054 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.429 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.499 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.53 0.176 0 CA-C-O 120.738 0.304 . . . . 0.0 111.186 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.481 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -144.51 158.26 43.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.424 179.688 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.48 119.29 6.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.042 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.68 HG23 ' H ' ' A' ' 9' ' ' GLU . 2.9 m -63.29 139.22 21.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.905 0.383 . . . . 0.0 110.985 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.544 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 28.5 t80 -51.06 -5.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.808 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.68 ' H ' HG23 ' A' ' 7' ' ' VAL . 28.0 mt-10 91.15 6.79 0.07 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.368 0.667 . . . . 0.0 111.39 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.583 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 52.5 t-20 113.47 74.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.1 0.875 . . . . 0.0 111.669 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 22' ' ' CYS . 4.1 t80 -54.11 144.05 40.76 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.532 ' O ' ' C ' ' A' ' 13' ' ' VAL . 19.7 Cg_endo -60.13 40.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.194 1.929 . . . . 0.0 112.678 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 11' ' ' TYR . 76.9 t 8.15 81.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 123.325 0.65 . . . . 0.0 112.598 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.5 p -175.77 20.8 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -172.05 101.74 0.17 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.163 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.8 OUTLIER -170.95 1.77 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.55 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.499 ' O ' HD12 ' A' ' 18' ' ' LEU . 19.3 mt-30 -78.16 50.95 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.064 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.639 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 2.2 mp -165.22 -114.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.773 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.639 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 165.67 46.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 0.0 110.703 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 21' ' ' GLN . 3.2 t-20 -137.9 -63.62 0.56 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.49 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.8 tp-100 -39.83 -72.23 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.866 0.365 . . . . 0.0 110.601 -179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 5.1 m -62.68 -45.18 93.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -50.34 -67.31 0.27 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.579 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.529 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.83 -50.82 55.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -43.39 -57.27 3.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.903 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 76.1 m -58.55 -45.33 89.15 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -57.05 0.48 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.508 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.794 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.1 tp -165.54 -131.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.501 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 35.3 -68.69 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 123.675 0.609 . . . . 0.0 112.481 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.794 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -87.47 -5.43 58.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.983 0.42 . . . . 0.0 110.098 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.547 ' N ' ' O ' ' A' ' 28' ' ' LEU . 1.6 m170 79.17 36.3 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.039 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.903 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.89 -179.69 5.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.578 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 53.0 mtt-85 -99.55 -28.75 13.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.228 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.5 p -175.95 -159.67 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.519 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.92 -176.16 41.38 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.936 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -176.34 158.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.819 0.342 . . . . 0.0 110.495 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.6 m -88.88 147.91 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.215 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -139.3 132.24 29.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.747 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.496 ' CE2' HD12 ' A' ' 45' ' ' LEU . 48.7 m-85 -89.78 139.21 30.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.91 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.599 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -93.48 76.42 4.44 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.096 0.474 . . . . 0.0 110.783 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' A' ' 40' ' ' ASP . 2.3 pt-20 19.02 44.94 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.631 -1.168 . . . . 0.0 112.114 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.9 mtpm? -142.3 -65.83 0.4 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.554 ' CG ' ' O ' ' A' ' 42' ' ' LYS . 2.3 mmm180 167.79 -21.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.915 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -87.98 172.35 9.63 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.772 HD13 ' N ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -149.53 168.97 22.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.497 0.665 . . . . 0.0 112.527 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -135.92 141.57 44.54 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.346 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 90.3 m -92.6 103.43 15.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.108 -179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 57.7 mt -84.54 120.17 34.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.614 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.1 m -92.76 116.1 28.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -90.76 120.77 32.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.244 0.545 . . . . 0.0 111.121 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.578 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 66.5 m-85 -97.81 13.62 29.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.654 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 73.0 m . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.913 -179.905 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.151 0 CA-C-O 120.679 0.276 . . . . 0.0 111.382 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.26 134.26 19.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.808 0.337 . . . . 0.0 110.674 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.97 131.8 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.443 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -64.55 141.57 18.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -44.52 -85.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.512 ' O ' ' N ' ' A' ' 11' ' ' TYR . 2.0 mt-10 -178.07 -155.3 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.702 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.56 ' O ' ' C ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -39.17 -25.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.562 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.684 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 2.3 t80 1.67 91.68 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.86 0.725 . . . . 0.0 111.685 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.519 ' O ' ' C ' ' A' ' 13' ' ' VAL . 60.6 Cg_endo -74.14 59.16 4.45 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 121.836 1.69 . . . . 0.0 112.269 -179.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.756 HG22 ' N ' ' A' ' 14' ' ' SER . 7.3 p 6.83 -119.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.452 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.756 ' N ' HG22 ' A' ' 13' ' ' VAL . 1.4 p 84.83 -2.78 0.93 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.039 0.447 . . . . 0.0 110.06 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.436 ' CG ' ' C ' ' A' ' 14' ' ' SER . 2.4 mttt -164.41 108.7 0.95 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.327 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -172.67 97.7 0.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.046 0.451 . . . . 0.0 111.142 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.483 ' CG ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mt-30 -172.71 23.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.304 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.82 146.33 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.525 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.26 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.133 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.58 ' O ' ' N ' ' A' ' 23' ' ' ASN . 4.1 t-20 -173.8 -132.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.061 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.529 ' C ' ' O ' ' A' ' 20' ' ' ASN . 13.4 mm-40 8.32 -87.43 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.979 0.8 . . . . 0.0 112.379 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 39.6 m -53.46 -56.68 14.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.955 0.407 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.58 ' N ' ' O ' ' A' ' 20' ' ' ASN . 2.5 t30 -52.46 -64.79 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.488 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -51.91 -50.97 60.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.135 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' A' ' 29' ' ' ASP . 67.8 m-20 -51.39 -60.27 3.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.889 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.445 ' C ' ' H ' ' A' ' 28' ' ' LEU . 66.9 m -54.51 -41.38 69.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.037 0.446 . . . . 0.0 110.169 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.516 ' HA ' ' HZ3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -59.48 3.75 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.17 -179.608 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.9 tt -163.27 -36.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.285 -0.566 . . . . 0.0 112.324 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 25' ' ' ASP . 85.4 m-20 -68.07 -44.07 77.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.801 0.334 . . . . 0.0 110.662 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.6 10.73 26.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m80 42.37 48.21 4.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.059 0.457 . . . . 0.0 110.008 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.582 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -85.97 -177.69 6.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.655 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.597 ' NE ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -101.67 -30.11 11.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.046 0.45 . . . . 0.0 110.343 179.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.584 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.2 OUTLIER -172.99 155.19 3.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.278 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.484 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 165.04 175.17 35.51 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.547 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 38' ' ' PHE . 10.8 pt-20 -178.2 -162.64 0.06 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.781 0.324 . . . . 0.0 110.734 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -87.06 129.22 35.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.279 179.475 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 36' ' ' GLU . 34.7 m-85 -147.05 167.07 24.98 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.334 0.587 . . . . 0.0 111.857 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.695 ' CE1' HD13 ' A' ' 45' ' ' LEU . 65.0 m-85 -98.17 -117.59 0.14 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.801 178.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.526 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.1 OUTLIER 51.4 149.55 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.42 0.629 . . . . 0.0 112.014 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.471 ' CG ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 89.41 -56.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.474 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.473 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 1.9 ttmt -149.63 30.61 0.74 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 54.72 18.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.995 0.426 . . . . 0.0 110.311 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.473 ' OD1' ' O ' ' A' ' 42' ' ' LYS . 6.6 m-20 -95.75 125.5 40.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.697 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.695 HD13 ' CE1' ' A' ' 39' ' ' TYR . 6.6 tp -85.78 112.4 21.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.813 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -142.22 161.32 38.31 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 112.23 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.684 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 73.0 m -75.62 96.66 3.6 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.873 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.3 mt -90.27 117.17 33.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.358 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 59.7 m -93.48 110.53 22.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.038 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' SER . 0.9 OUTLIER -93.1 160.67 14.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.786 0.803 . . . . 0.0 112.265 -178.993 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 4' ' ' CYS . 87.4 m-85 -128.35 -28.41 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.209 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.749 179.7 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.532 0.262 0 CA-C-O 120.641 0.258 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.85 154.87 43.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.726 0.298 . . . . 0.0 110.765 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -151.12 121.14 7.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.293 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -63.06 116.35 2.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.564 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -55.52 76.45 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.129 -179.476 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 7' ' ' VAL . 50.5 mt-10 8.81 117.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.511 ' C ' ' O ' ' A' ' 9' ' ' GLU . 6.0 m-20 14.47 52.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.613 ' O ' ' N ' ' A' ' 13' ' ' VAL . 87.4 t80 -54.6 136.61 62.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.414 ' HD2' ' CD1' ' A' ' 11' ' ' TYR . 76.6 Cg_exo -40.43 84.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 121.852 1.701 . . . . 0.0 111.768 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -56.61 106.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.53 -179.061 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 89.2 p -175.75 -86.55 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.06 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.581 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -69.59 159.28 33.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.949 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.581 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.0 m -170.58 -79.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.678 0.275 . . . . 0.0 111.393 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' LEU . 2.4 mp0 63.08 13.22 6.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.151 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.62 HD12 ' N ' ' A' ' 18' ' ' LEU . 4.4 mp 28.38 57.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.325 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 173.86 35.53 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.03 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.574 ' O ' ' N ' ' A' ' 23' ' ' ASN . 1.2 t-20 -174.5 -118.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.676 ' H ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -1.01 -83.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.997 0.811 . . . . 0.0 112.209 179.534 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 0.3 OUTLIER -58.57 -50.78 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.256 -179.755 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -51.55 -69.04 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.931 0.396 . . . . 0.0 110.51 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.47 -47.12 66.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.935 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 29' ' ' ASP . 94.9 m-20 -56.9 -67.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.602 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 28' ' ' LEU . 4.3 m -50.42 -40.52 50.46 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.227 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -58.91 5.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.665 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.649 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.2 tm? -163.46 -40.92 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.878 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 25' ' ' ASP . 32.4 m-20 -68.21 -53.07 27.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.746 0.307 . . . . 0.0 111.298 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -99.74 18.63 17.68 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.904 0.383 . . . . 0.0 111.097 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 41.46 35.65 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.886 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.502 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.44 -171.91 3.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.16 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -95.17 -48.0 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.825 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.476 ' O ' ' OD2' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -163.48 145.8 9.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.076 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.4 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -114.91 178.21 17.79 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.895 -0.669 . . . . 0.0 113.314 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.4 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 4.8 mt-10 -174.66 139.98 0.57 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -88.78 145.28 25.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 0.0 110.896 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -144.04 142.16 30.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.929 0.395 . . . . 0.0 110.718 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.535 ' CE2' HD21 ' A' ' 45' ' ' LEU . 63.2 m-85 -72.21 -177.7 2.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.866 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.589 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.3 OUTLIER 163.35 -172.2 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.419 0.628 . . . . 0.0 111.195 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.8 OUTLIER 24.95 -82.23 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.143 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.604 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 26.2 mmtt -134.26 79.29 1.8 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.831 0.348 . . . . 0.0 111.645 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 46.65 28.38 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.121 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.604 ' OD1' ' N ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -94.44 122.83 37.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.622 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.535 HD21 ' CE2' ' A' ' 39' ' ' TYR . 12.1 mt -89.08 109.11 20.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.685 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -93.22 135.84 34.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.657 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.487 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.3 m -77.21 100.97 5.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -86.78 116.73 29.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.556 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 99.2 m -93.76 111.47 23.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.865 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.502 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -88.0 143.32 27.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.524 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -112.46 -3.9 14.34 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.86 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.9 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.741 0.305 . . . . 0.0 110.761 -179.921 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.536 0.405 0 CA-C-O 120.863 0.364 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -146.01 139.17 25.92 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.032 0.444 . . . . 0.0 111.55 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.432 ' NZ ' ' OH ' ' A' ' 51' ' ' TYR . 25.8 pttt -151.77 140.72 21.08 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.754 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.511 HG12 ' OE1' ' A' ' 46' ' ' GLN . 0.8 OUTLIER -59.98 154.94 3.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 121.22 0.533 . . . . 0.0 111.818 -178.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.714 ' CE2' ' CZ ' ' A' ' 11' ' ' TYR . 57.1 t80 -91.05 -16.77 27.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.602 -178.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.53 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 22.48 110.97 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.367 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 11' ' ' TYR . 1.4 t-20 170.27 -71.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 177.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.714 ' CZ ' ' CE2' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -46.72 173.54 0.04 OUTLIER Pre-proline 0 C--O 1.231 0.087 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.708 179.73 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.74 ' O ' HG12 ' A' ' 13' ' ' VAL . 16.7 Cg_exo -66.05 -14.84 46.28 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.358 1.372 . . . . 0.0 110.189 178.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.74 HG12 ' O ' ' A' ' 12' ' ' PRO . 1.9 p 103.94 -20.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.224 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.78 -33.67 75.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.682 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -69.19 147.26 51.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 110.57 179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.47 ' SG ' HD22 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -175.55 -75.74 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 -179.887 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 49.56 29.91 3.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.2 0.524 . . . . 0.0 110.072 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.3 mt 44.69 -133.45 0.75 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.408 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.23 80.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.562 ' O ' ' N ' ' A' ' 22' ' ' CYS . 1.8 t-20 -176.83 -117.14 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.902 0.382 . . . . 0.0 111.69 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.591 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 1.8 tp60 -57.73 54.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 112.277 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.591 ' SG ' ' O ' ' A' ' 21' ' ' GLN . 1.7 m 177.8 -58.79 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.529 HD22 ' C ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER -59.19 -52.0 67.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.387 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -48.9 78.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.879 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.499 ' OD1' ' N ' ' A' ' 22' ' ' CYS . 3.7 m-20 -52.8 -53.91 41.63 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.348 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 28' ' ' LEU . 71.7 m -53.39 -46.62 69.75 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 13.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.511 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 26' ' ' CYS . 52.7 tp -165.27 -36.37 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.415 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -68.62 -44.43 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.623 0.249 . . . . 0.0 111.021 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.471 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 42.2 mmtt -107.79 -0.16 21.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.195 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.471 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER 75.78 35.7 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -87.13 177.39 7.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.213 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -107.43 -5.37 17.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.577 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.406 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER 174.39 -169.26 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.365 -179.815 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -173.65 -165.03 29.8 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.636 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.502 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 2.0 mt-10 -176.44 -164.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 110.366 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.4 m -144.17 132.35 21.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.628 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.788 ' CD2' HD12 ' A' ' 48' ' ' ILE . 97.8 m-85 -146.62 169.86 18.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.071 0.462 . . . . 0.0 111.531 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.614 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.0 m-85 -100.84 120.15 39.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.639 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.681 ' O ' ' N ' ' A' ' 42' ' ' LYS . 5.3 p-10 -122.65 123.38 41.02 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 40' ' ' ASP . 15.2 tt0 21.74 35.17 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.855 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.681 ' N ' ' O ' ' A' ' 40' ' ' ASP . 19.4 mtmm -147.1 -6.24 0.5 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.687 0.279 . . . . 0.0 111.34 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 31.6 mmt-85 57.56 10.08 0.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.008 0.432 . . . . 0.0 110.049 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 10.2 m-20 -94.73 -130.91 0.15 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.303 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.682 ' O ' HG22 ' A' ' 13' ' ' VAL . 2.3 mt -152.95 95.17 1.94 Allowed 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.511 ' OE1' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -89.7 156.1 18.77 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 178.702 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 13.3 m -106.65 115.18 29.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.062 0.458 . . . . 0.0 111.292 -178.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.788 HD12 ' CD2' ' A' ' 38' ' ' PHE . 23.0 mt -88.93 132.29 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.727 -178.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 92.1 m -100.38 112.47 24.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.005 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.471 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.4 OUTLIER -94.24 140.51 29.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.203 0.525 . . . . 0.0 111.302 -179.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.432 ' OH ' ' NZ ' ' A' ' 6' ' ' LYS . 71.7 m-85 -113.46 -24.91 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.167 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.174 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.17 0 CA-C-O 120.715 0.293 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -118.11 134.14 55.27 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.858 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -149.22 125.49 10.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.998 0.428 . . . . 0.0 111.27 179.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.33 144.27 14.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.434 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.51 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.5 t80 -84.68 61.89 7.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.926 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.637 ' O ' ' N ' ' A' ' 11' ' ' TYR . 4.1 mm-40 32.94 -159.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.625 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -58.73 44.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.207 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.637 ' N ' ' O ' ' A' ' 9' ' ' GLU . 7.0 t80 -52.92 134.41 48.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.552 ' C ' ' H ' ' A' ' 14' ' ' SER . 84.6 Cg_exo -39.32 85.54 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.156 1.904 . . . . 0.0 112.475 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' TYR . 9.6 p -57.48 1.3 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.401 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.552 ' H ' ' C ' ' A' ' 12' ' ' PRO . 35.7 p -62.94 -95.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.286 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.66 113.79 5.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.007 0.432 . . . . 0.0 111.447 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -175.06 108.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.205 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -143.24 -23.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.674 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.13 -178.94 4.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 110.961 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.43 112.1 1.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.57 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.407 ' OD1' ' OE1' ' A' ' 21' ' ' GLN . 0.8 OUTLIER -175.55 -105.66 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.782 179.42 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.494 ' O ' ' OD2' ' A' ' 25' ' ' ASP . 9.6 mm100 -50.05 -55.89 12.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.851 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.7 t -55.7 -57.38 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.26 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -51.45 -64.88 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.874 0.368 . . . . 0.0 110.625 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.552 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.69 -47.03 64.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.326 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.555 ' O ' ' N ' ' A' ' 29' ' ' ASP . 20.1 m-20 -52.12 -64.71 0.73 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.5 ' C ' ' H ' ' A' ' 28' ' ' LEU . 89.9 m -51.32 -50.32 59.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -61.87 14.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.712 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.3 tm? -163.73 -41.01 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.265 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.555 ' N ' ' O ' ' A' ' 25' ' ' ASP . 3.5 m-20 -67.43 -47.61 69.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.1 mtpm? -101.25 6.53 42.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.829 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.401 ' CD2' ' N ' ' A' ' 31' ' ' HIS . 0.1 OUTLIER 58.15 36.66 26.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.535 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.75 -174.77 5.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.038 0.447 . . . . 0.0 111.467 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.4 tpt85 -93.87 -25.96 17.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.7 p -176.35 -164.11 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.287 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 159.83 176.02 31.45 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.792 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -177.0 164.43 2.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 0.0 110.437 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 136.82 33.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.872 0.368 . . . . 0.0 110.519 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -146.73 162.16 39.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 23.0 m-85 -86.07 175.95 8.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.03 0.443 . . . . 0.0 111.462 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.596 ' CG ' HD22 ' A' ' 44' ' ' ASN . 17.9 p-10 -109.41 173.21 6.42 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.322 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' OE1' ' N ' ' A' ' 41' ' ' GLU . 53.0 mp0 -65.14 27.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.673 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.595 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 -74.15 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.571 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.467 ' O ' ' CG ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER 169.71 70.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.387 179.631 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 70.8 m-80 -141.61 -155.42 0.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.428 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.55 137.05 21.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.807 0.337 . . . . 0.0 110.608 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -146.97 139.69 25.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.586 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -82.65 100.2 10.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.318 179.517 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.2 mm -82.89 112.58 20.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.556 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.7 m -95.76 117.51 30.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.227 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.505 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.1 OUTLIER -95.01 143.65 26.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.929 0.395 . . . . 0.0 110.727 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -114.23 -26.67 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.611 -179.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.2 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.743 0.306 . . . . 0.0 110.887 179.864 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.743 0.306 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.61 153.35 40.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.763 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -149.71 128.92 12.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.116 0.484 . . . . 0.0 111.638 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.409 HG12 HD11 ' A' ' 48' ' ' ILE . 5.6 m -64.34 146.3 13.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.615 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.75 76.96 7.15 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.559 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.5 pt-20 -61.58 82.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.416 -178.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 1.3 t-20 153.73 -2.82 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.286 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.639 ' CE1' ' SG ' ' A' ' 47' ' ' CYS . 3.9 t80 -55.83 129.43 71.64 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.632 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.535 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.4 Cg_exo -59.77 45.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 121.91 1.74 . . . . 0.0 113.256 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 11' ' ' TYR . 36.0 t 2.97 93.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 123.705 0.628 . . . . 0.0 112.665 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.504 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 85.1 p -171.22 -97.41 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.154 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.504 ' N ' ' OG ' ' A' ' 14' ' ' SER . 18.0 tttp -63.93 117.11 6.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.95 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -172.0 -12.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.019 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.41 ' H ' ' HG2' ' A' ' 17' ' ' GLN . 14.8 mm-40 -80.39 33.18 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.597 0.237 . . . . 0.0 110.79 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.4 ' H ' ' C ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -166.96 116.97 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.724 -179.672 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.77 99.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.654 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.491 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.6 OUTLIER -168.82 -86.78 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -45.55 -61.0 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.306 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.574 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.6 t -58.16 -54.46 46.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.43 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.443 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 2.2 t30 -51.03 -63.4 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.497 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.44 -47.94 62.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.243 179.312 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 29' ' ' ASP . 14.6 m-20 -50.81 -62.6 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.506 ' C ' ' H ' ' A' ' 28' ' ' LEU . 80.4 m -53.85 -41.4 67.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -59.99 7.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.063 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.506 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -162.36 -40.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.045 -179.375 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.506 ' N ' ' O ' ' A' ' 25' ' ' ASP . 71.8 m-20 -67.35 -54.28 21.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.767 0.318 . . . . 0.0 111.004 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 1.3 mmmm -102.25 29.9 4.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.888 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 7.9 m170 33.09 39.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.427 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.671 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -89.01 -176.11 5.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.678 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -95.92 -26.12 15.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.07 0.462 . . . . 0.0 110.458 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.451 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -175.17 -159.14 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.07 -179.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.451 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 164.72 -172.0 40.32 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.978 -1.106 . . . . 0.0 113.456 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 4.9 tt0 -177.07 -144.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.914 0.388 . . . . 0.0 110.521 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.09 133.84 17.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.648 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -149.66 -177.96 6.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.222 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -90.31 -166.79 1.67 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.863 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.471 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -176.41 -173.07 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.612 -179.755 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -60.52 -2.57 0.52 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.399 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.528 ' C ' ' H ' ' A' ' 44' ' ' ASN . 6.0 mmtp -100.81 -1.43 34.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.086 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 59.47 -2.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.243 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.528 ' H ' ' C ' ' A' ' 42' ' ' LYS . 2.1 m120 -94.97 158.81 15.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.695 0.283 . . . . 0.0 110.749 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mt -87.84 133.2 33.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -146.5 157.2 43.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.187 0.518 . . . . 0.0 111.363 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.639 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -70.77 157.33 38.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.121 -179.72 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.409 HD11 HG12 ' A' ' 7' ' ' VAL . 0.9 OUTLIER -143.43 111.85 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.953 -179.819 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.8 m -92.22 119.0 31.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.887 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.671 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 1.7 t70 -92.7 158.39 15.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.441 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -129.92 -36.11 1.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 34.5 m . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.918 -179.748 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.8 m . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.895 0.378 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 138.4 26.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.939 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.556 ' C ' HG12 ' A' ' 7' ' ' VAL . 3.6 mtpm? -147.84 -156.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.128 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.556 HG12 ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -168.52 158.84 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.627 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.13 114.31 22.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.034 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -65.42 4.91 0.47 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.412 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.627 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 9.3 p30 178.23 136.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.727 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.6 t80 -179.42 100.92 0.19 Allowed Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.928 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.642 ' O ' ' N ' ' A' ' 14' ' ' SER . 80.7 Cg_exo -45.39 65.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.885 2.39 . . . . 0.0 113.624 -178.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.727 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.4 t 8.98 51.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 123.967 0.907 . . . . 0.0 113.297 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.642 ' N ' ' O ' ' A' ' 12' ' ' PRO . 2.8 p -68.7 135.64 51.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 0.0 111.915 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 26.66 32.37 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.579 ' N ' ' O ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -71.52 82.05 0.81 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.469 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -161.53 -42.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.977 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -73.06 -103.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.501 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.52 22.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.506 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.591 ' O ' ' N ' ' A' ' 22' ' ' CYS . 18.5 t-20 -114.59 -112.16 0.34 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.021 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.563 ' C ' ' O ' ' A' ' 20' ' ' ASN . 11.6 mm-40 0.89 -68.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.775 0.672 . . . . 0.0 111.827 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 42.7 t -60.94 -68.15 0.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.694 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.5 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -47.17 -46.96 23.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.226 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.05 -48.97 78.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.096 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -52.37 -57.0 11.2 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.393 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.648 ' C ' ' H ' ' A' ' 28' ' ' LEU . 91.6 m -58.13 -44.05 87.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -61.43 11.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.54 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.699 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.2 tp -160.89 -134.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.071 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 40.41 -76.87 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.175 0.297 . . . . 0.0 111.77 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 28' ' ' LEU . 9.9 mmtp -90.6 -9.16 48.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 110.557 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.455 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 3.3 m170 79.91 49.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.206 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.642 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.92 -136.57 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.157 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -141.45 -53.63 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.665 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -155.92 133.34 10.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.641 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.45 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . -105.98 -157.19 22.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.5 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -172.14 131.54 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 87.2 m -90.36 123.3 33.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.724 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.442 ' CE1' HG13 ' A' ' 48' ' ' ILE . 23.2 p90 -149.16 140.7 23.39 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 120.513 -0.475 . . . . 0.0 112.017 -179.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.51 ' HA ' ' H ' ' A' ' 45' ' ' LEU . 59.5 m-85 -72.69 133.87 44.8 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.66 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 42' ' ' LYS . 13.1 p-10 -146.68 -166.13 2.41 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.458 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.488 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.4 tt0 22.23 42.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.186 -178.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.58 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.2 mtpt 68.96 83.05 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.207 178.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.4 ttp85 61.54 52.73 3.56 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.002 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -93.34 -60.31 1.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.51 ' H ' ' HA ' ' A' ' 39' ' ' TYR . 11.9 tp 76.92 67.19 0.05 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.296 -178.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -91.87 -175.96 4.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.015 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -127.27 123.56 36.74 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.534 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -87.58 155.05 3.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.499 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.3 m -135.28 108.7 7.85 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.039 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -94.29 134.77 36.42 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -101.36 -24.67 14.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.93 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.1 m . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.019 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.231 0.083 0 CA-C-O 121.001 0.429 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.466 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -118.38 126.89 53.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.914 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.45 138.03 47.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.069 0.462 . . . . 0.0 111.787 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.739 HG23 ' H ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -61.41 146.98 11.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.62 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.609 ' CG ' ' O ' ' A' ' 8' ' ' TYR . 2.2 t80 -92.11 42.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.962 0.41 . . . . 0.0 110.429 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.739 ' H ' HG23 ' A' ' 7' ' ' VAL . 4.5 pt-20 17.83 76.96 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.031 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.543 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 7.3 m120 103.74 145.41 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.059 0.849 . . . . 0.0 110.827 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 13' ' ' VAL . 39.4 t80 -179.32 123.7 0.24 Allowed Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.421 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_exo -41.75 82.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.293 1.995 . . . . 0.0 112.733 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.575 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.1 t -55.21 95.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 p -175.26 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -26.3 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.101 0.477 . . . . 0.0 110.123 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.449 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -68.09 90.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.735 179.236 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.654 ' H ' HD12 ' A' ' 18' ' ' LEU . 30.2 mt-30 -158.29 21.4 0.24 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.652 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.916 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -165.69 -79.55 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.739 0.304 . . . . 0.0 111.044 -179.588 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -178.01 -159.83 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 -178.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.505 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER 60.83 -72.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.381 -179.462 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.545 ' N ' ' O ' ' A' ' 19' ' ' ALA . 6.0 mm-40 -39.49 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.6 t -59.57 -46.41 88.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.704 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -76.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.234 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.497 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.58 -43.33 35.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.467 179.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 29' ' ' ASP . 46.0 m-20 -50.37 -60.54 2.89 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.542 ' C ' ' H ' ' A' ' 28' ' ' LEU . 81.9 m -55.97 -39.53 71.94 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.275 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -59.69 7.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.836 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.542 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.8 tt -163.35 -26.07 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.638 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 25' ' ' ASP . 17.8 m-20 -70.03 -51.81 29.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 110.649 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 3.7 mmmm -110.21 0.24 18.1 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.969 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.499 ' N ' ' CD2' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 66.75 41.53 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.429 -179.594 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.535 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -85.83 -178.61 6.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.365 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -95.65 -10.57 29.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.071 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 174.67 -169.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.987 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.71 170.24 37.61 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.835 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.04 153.19 0.78 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -88.43 137.16 32.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.569 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -146.4 159.99 42.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -69.65 -168.64 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.612 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -161.64 156.69 23.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.461 0.648 . . . . 0.0 112.67 -179.782 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 40' ' ' ASP . 5.1 mm-40 11.73 -69.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.378 -1.283 . . . . 0.0 114.137 179.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -88.75 -57.1 3.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.388 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER 164.25 31.44 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.903 0.382 . . . . 0.0 110.02 -179.738 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.508 HD22 ' N ' ' A' ' 44' ' ' ASN . 0.9 OUTLIER -94.68 135.77 35.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.594 179.458 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.586 HD13 ' N ' ' A' ' 46' ' ' GLN . 1.9 tm? -86.43 131.93 34.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.179 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.586 ' N ' HD13 ' A' ' 45' ' ' LEU . 38.1 mt-30 -142.25 165.47 27.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.543 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.458 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -97.19 103.69 15.65 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.413 -179.494 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.558 ' N ' HD13 ' A' ' 48' ' ' ILE . 1.9 mm -93.69 119.81 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.1 m -94.49 123.37 37.87 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.208 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.535 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 15.1 t70 -94.67 136.9 34.44 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.179 0.514 . . . . 0.0 111.373 -179.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -110.68 -9.61 14.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.56 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.7 m . . . . . 0 N--CA 1.463 0.219 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.039 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 62.9 m . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.759 0.314 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.15 118.95 37.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.451 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -149.82 115.8 5.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.053 0.454 . . . . 0.0 112.103 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.431 HG12 HG12 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -70.69 148.0 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 178.745 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.683 ' CD1' ' ND2' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -103.96 -7.44 20.37 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.027 179.58 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 8' ' ' TYR . 2.0 tm-20 30.23 104.82 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.105 -0.952 . . . . 0.0 112.095 -178.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.779 HD22 ' N ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER 170.5 -44.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.264 179.003 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.779 ' N ' HD22 ' A' ' 10' ' ' ASN . 55.0 t80 -53.62 139.37 49.98 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.737 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 14' ' ' SER . 94.5 Cg_exo -39.59 95.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.081 1.854 . . . . 0.0 112.058 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.2 p -53.02 -7.17 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 12' ' ' PRO . 96.9 p -65.25 -88.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.082 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.472 ' N ' ' OG ' ' A' ' 14' ' ' SER . 35.8 tptt -66.02 139.65 58.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.756 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.75 22.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.915 0.388 . . . . 0.0 110.974 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -113.77 57.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.185 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.593 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -168.88 124.99 0.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.96 54.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.552 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.593 ' N ' ' O ' ' A' ' 18' ' ' LEU . 9.8 t-20 -159.82 -73.81 0.07 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.442 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.581 ' O ' ' CB ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -53.05 90.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.969 179.299 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.581 ' CB ' ' O ' ' A' ' 21' ' ' GLN . 52.3 t 120.61 -57.95 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.613 1.196 . . . . 0.0 109.878 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 0.1 OUTLIER -56.5 -54.7 42.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.031 0.443 . . . . 0.0 109.854 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.519 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -55.18 -48.2 74.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.185 179.147 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.595 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -53.09 -51.27 62.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.069 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.819 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 22.2 m -56.27 -44.31 79.64 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.6 tttp -60.76 12.27 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.132 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.648 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -162.16 -129.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.664 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.576 ' H ' HD12 ' A' ' 28' ' ' LEU . 0.4 OUTLIER 40.05 -81.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.706 0.289 . . . . 0.0 111.292 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.648 ' N ' ' O ' ' A' ' 28' ' ' LEU . 18.0 mttm -95.3 5.25 52.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.5 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.563 ' N ' ' O ' ' A' ' 28' ' ' LEU . 3.3 m170 71.94 56.47 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.819 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.58 177.53 6.52 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.494 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -96.78 -21.83 17.31 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.094 0.473 . . . . 0.0 109.864 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.494 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 1.5 p 158.59 137.86 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.049 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.439 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -128.67 -173.17 13.36 Favored Glycine 0 CA--C 1.51 -0.221 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.398 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -179.0 158.95 0.96 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 0.0 110.531 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.8 m -87.17 138.51 31.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.579 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -138.24 157.48 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.876 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.628 ' CE1' HD21 ' A' ' 45' ' ' LEU . 68.1 m-85 -93.22 -169.76 2.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.794 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.554 ' C ' ' H ' ' A' ' 42' ' ' LYS . 30.2 p30 -166.58 -172.3 2.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -65.04 18.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.827 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.554 ' H ' ' C ' ' A' ' 40' ' ' ASP . 12.3 mmtp -138.25 17.89 2.78 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.929 0.395 . . . . 0.0 111.043 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.11 13.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.463 179.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.404 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 91.2 m-20 -94.67 141.33 28.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.808 0.337 . . . . 0.0 111.166 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.628 HD21 ' CE1' ' A' ' 39' ' ' TYR . 16.7 mt -87.78 147.35 25.21 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.943 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.404 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 2.5 mp0 -147.05 134.49 20.8 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.29 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . 1.5 m -77.42 102.19 6.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.435 0.636 . . . . 0.0 112.391 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.431 HG12 HG12 ' A' ' 7' ' ' VAL . 5.0 mt -89.28 117.34 32.44 Favored 'Isoleucine or valine' 0 C--N 1.341 0.208 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.077 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.2 m -93.97 115.61 27.98 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 110.101 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.465 ' OD2' ' O ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.05 129.24 44.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.447 0.642 . . . . 0.0 110.597 179.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -102.38 -12.41 17.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.001 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.051 -179.981 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.2 m . . . . . 0 CA--C 1.527 0.062 0 CA-C-O 120.684 0.278 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.9 pttt -146.26 131.47 18.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.852 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -145.44 124.94 13.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.409 . . . . 0.0 111.088 -179.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.04 129.28 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.43 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.97 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.604 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 176.13 -173.43 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.556 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.723 ' O ' ' O ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -19.51 -42.13 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.968 -179.756 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.723 ' O ' ' O ' ' A' ' 10' ' ' ASN . 59.1 t80 20.15 131.11 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.588 ' C ' ' H ' ' A' ' 14' ' ' SER . 49.0 Cg_endo -67.62 102.35 0.72 Allowed 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.98 1.787 . . . . 0.0 112.624 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.517 ' O ' HG12 ' A' ' 13' ' ' VAL . 9.3 t -59.83 10.83 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.767 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.588 ' H ' ' C ' ' A' ' 12' ' ' PRO . 95.7 p -61.0 -5.58 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.599 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -166.78 127.85 1.65 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.016 0.436 . . . . 0.0 111.211 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 60.9 m -166.42 11.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.76 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.4 8.13 41.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.518 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.645 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -159.51 136.98 9.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.21 0.528 . . . . 0.0 110.495 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.734 ' HB1' HD22 ' A' ' 23' ' ' ASN . . . -59.41 113.85 2.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.667 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.519 ' O ' ' C ' ' A' ' 21' ' ' GLN . 0.6 OUTLIER -175.83 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.844 179.441 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.519 ' C ' ' O ' ' A' ' 20' ' ' ASN . 72.0 tp60 -16.34 -74.37 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.92 0.763 . . . . 0.0 112.009 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.3 t -57.98 -49.25 77.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.734 HD22 ' HB1' ' A' ' 19' ' ' ALA . 44.8 t-20 -53.8 -69.56 0.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.144 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -38.96 32.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.562 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 29' ' ' ASP . 13.9 m-20 -55.45 -63.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.394 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.47 ' C ' ' H ' ' A' ' 28' ' ' LEU . 16.4 m -56.38 -38.95 72.15 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.57 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.196 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.647 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.3 tm? -163.24 -41.17 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.5 -0.48 . . . . 0.0 112.046 -179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.551 ' N ' ' O ' ' A' ' 25' ' ' ASP . 96.6 m-20 -68.26 -16.44 63.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 110.895 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -143.33 22.69 1.85 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.237 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 40.74 39.58 0.8 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.11 0.481 . . . . 0.0 111.131 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.37 -173.79 4.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.846 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.55 -40.74 9.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.229 0.537 . . . . 0.0 110.494 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -161.28 175.46 12.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.686 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -158.77 146.58 13.33 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.408 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -175.73 156.52 1.86 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.419 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 2.8 m -88.38 145.19 25.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.432 0.634 . . . . 0.0 112.553 -178.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -143.3 163.37 33.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.437 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.4 166.75 22.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.707 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.487 ' O ' ' C ' ' A' ' 41' ' ' GLU . 2.1 p30 -171.53 176.11 3.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.635 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.487 ' C ' ' O ' ' A' ' 40' ' ' ASP . 69.7 mm-40 15.42 -90.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.687 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 mtpt -99.68 63.8 1.25 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.734 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 40.41 50.18 2.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.374 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.28 121.25 42.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.553 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.77 86.65 7.35 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -99.36 144.36 28.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.226 -178.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.672 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -63.02 101.42 0.27 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.322 179.601 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mt -92.59 120.79 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.108 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.4 m -92.47 116.3 28.87 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.26 139.65 30.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.245 0.545 . . . . 0.0 111.281 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -109.42 -22.47 12.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.296 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.318 . . . . 0.0 111.27 -179.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.456 -0.172 0 CA-C-O 120.697 0.284 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.911 0.386 . . . . 0.0 111.513 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.55 ' C ' HG12 ' A' ' 7' ' ' VAL . 38.8 mttt -144.99 -164.46 1.93 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.301 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.55 HG12 ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -167.69 157.16 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.432 . . . . 0.0 110.971 -179.42 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.604 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.86 107.78 17.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.991 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.49 4.88 0.33 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.604 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 4.9 p30 172.96 123.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.987 0.423 . . . . 0.0 110.701 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.558 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER 178.66 156.79 0.6 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.439 -179.843 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.404 ' C ' ' O ' ' A' ' 11' ' ' TYR . 41.5 Cg_exo -30.11 84.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 123.31 2.674 . . . . 0.0 112.939 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.558 ' N ' ' O ' ' A' ' 11' ' ' TYR . 8.8 t -57.2 -36.74 52.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.546 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.33 -49.96 73.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.028 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -64.48 99.13 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.964 0.411 . . . . 0.0 110.388 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -172.08 110.64 0.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.286 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.495 ' O ' ' O ' ' A' ' 18' ' ' LEU . 75.7 mt-30 -137.36 52.85 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.651 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 20.8 mt 32.87 97.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.98 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 99.99 146.48 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 O-C-N 123.679 0.612 . . . . 0.0 111.422 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER 63.66 -79.3 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.671 179.359 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.53 39.99 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.586 ' N ' ' O ' ' A' ' 20' ' ' ASN . 9.9 t -179.58 -52.82 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.441 ' OD1' ' C ' ' A' ' 23' ' ' ASN . 10.8 t-20 -58.26 -54.24 49.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.146 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.523 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -57.39 -44.36 84.43 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.71 178.868 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 29' ' ' ASP . 0.1 OUTLIER -54.3 -58.64 6.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.521 179.729 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.55 ' C ' ' H ' ' A' ' 28' ' ' LEU . 85.1 m -55.11 -42.1 72.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -62.28 12.26 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.697 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.55 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.2 tp -162.86 -44.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.631 -179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.641 ' N ' ' O ' ' A' ' 25' ' ' ASP . 94.1 m-20 -68.34 -17.41 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.056 0.455 . . . . 0.0 110.496 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.429 ' NZ ' ' O ' ' A' ' 7' ' ' VAL . 41.8 mttt -140.24 3.63 1.97 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.05 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.4 m170 53.23 35.9 21.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.965 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.657 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.46 -167.76 1.99 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -97.17 -44.75 6.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.023 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 84.0 p -157.69 -155.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.099 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 158.23 -171.53 35.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.448 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -175.98 162.61 2.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.933 0.397 . . . . 0.0 111.123 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 73.3 m -88.81 138.1 31.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.092 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -148.74 146.82 28.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.922 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.404 ' CE1' ' HG ' ' A' ' 45' ' ' LEU . 64.9 m-85 -86.36 160.64 19.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.6 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -93.33 -172.92 3.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.618 179.587 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -65.49 19.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.54 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.6 ' H ' ' C ' ' A' ' 40' ' ' ASP . 13.4 mtpp -140.93 -73.41 0.34 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.092 179.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.453 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 9.8 mtp85 153.45 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.644 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.47 ' O ' ' O ' ' A' ' 45' ' ' LEU . 0.7 OUTLIER -109.48 -0.25 18.95 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -178.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.47 ' O ' ' O ' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 57.3 136.77 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.752 0.311 . . . . 0.0 111.074 179.791 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -147.78 170.62 17.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.837 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.12 108.99 13.98 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.095 0.474 . . . . 0.0 111.515 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.9 mt -87.06 129.25 38.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.51 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.5 m -110.11 118.73 37.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.853 0.358 . . . . 0.0 111.187 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.657 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 4.8 t0 -96.55 152.95 18.15 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.794 179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 32' ' ' ALA . 13.8 m-85 -130.23 3.62 4.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.958 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 40.9 m . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.423 -179.954 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 CA-C-O 120.78 0.324 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.457 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -141.11 113.99 8.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.435 179.828 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -98.54 125.36 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.189 -179.098 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.435 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -66.98 146.25 13.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.626 178.801 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.57 84.22 6.81 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.096 0.474 . . . . 0.0 109.8 179.246 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.585 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -67.08 113.91 5.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.687 179.839 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.585 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 23.3 t-20 117.17 -34.25 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 O-C-N 124.144 0.902 . . . . 0.0 110.698 179.835 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.577 ' O ' ' O ' ' A' ' 12' ' ' PRO . 38.2 t80 -41.25 140.32 1.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.241 -179.995 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.577 ' O ' ' O ' ' A' ' 11' ' ' TYR . 72.6 Cg_exo -48.22 -146.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.413 2.075 . . . . 0.0 113.408 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.56 HG22 ' C ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -169.99 74.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.449 -179.984 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.9 p -174.17 -64.93 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -67.72 97.28 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.256 179.103 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 0.8 OUTLIER -170.97 113.0 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.44 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mm-40 156.72 -48.85 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.897 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' C ' ' A' ' 19' ' ' ALA . 10.9 mt -71.16 52.86 0.17 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.004 -179.542 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.544 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 3.78 84.97 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.974 0.797 . . . . 0.0 112.26 179.313 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.485 ' O ' ' C ' ' A' ' 21' ' ' GLN . 2.7 t-20 -164.18 -96.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.283 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.485 ' C ' ' O ' ' A' ' 20' ' ' ASN . 16.2 mm-40 -28.88 -76.8 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.489 -179.514 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.2 t -48.12 -64.95 0.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.904 0.383 . . . . 0.0 111.616 -179.735 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.504 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 2.8 t30 -47.63 -70.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.681 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -50.61 -43.32 56.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.3 m-20 -51.77 -65.59 0.53 Allowed 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.509 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.41 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.5 m -52.8 -42.08 64.74 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.068 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.9 tttp -59.14 1.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.747 -179.698 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.41 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.0 tt -167.81 -44.8 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.732 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 14.3 m-20 -64.62 -2.19 2.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.944 0.402 . . . . 0.0 110.78 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.7 mttm -144.75 8.58 1.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.33 179.338 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 53.48 36.03 22.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.768 179.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.593 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -88.11 -178.21 5.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 111.451 -179.691 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.485 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -93.68 -31.32 14.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.465 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.1 p -176.72 -160.9 0.07 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.776 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.504 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 146.68 173.41 17.89 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.249 -0.977 . . . . 0.0 112.775 179.615 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.408 ' HG3' ' H ' ' A' ' 37' ' ' CYS . 0.4 OUTLIER -176.49 179.01 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.844 0.354 . . . . 0.0 110.652 179.964 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.408 ' H ' ' HG3' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -87.44 103.29 15.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.531 179.712 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -95.22 152.49 18.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.417 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.635 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 20.0 m-85 -96.5 -166.8 1.47 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.287 179.269 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.591 ' C ' ' H ' ' A' ' 42' ' ' LYS . 14.1 p-10 -133.68 -174.06 3.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.815 0.34 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.69 28.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.858 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -145.6 -81.76 0.15 Allowed 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.268 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.08 39.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.441 179.142 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.635 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 2.7 m120 -90.17 -168.1 2.03 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.143 -179.315 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.49 HD21 ' CE1' ' A' ' 39' ' ' TYR . 7.7 mt -152.3 133.64 14.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 111.619 -179.552 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -148.51 137.81 21.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.114 179.065 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.09 96.2 6.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.96 0.41 . . . . 0.0 111.217 -179.351 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.72 114.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.713 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -93.14 115.06 27.72 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.593 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 7.4 t70 -87.92 142.94 27.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.969 0.414 . . . . 0.0 111.584 -178.932 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -118.01 -27.26 6.18 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.485 -179.663 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.276 -179.358 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 120.738 0.304 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm -138.0 129.08 27.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -148.89 126.47 11.68 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.815 0.341 . . . . 0.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -63.22 158.28 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.338 179.055 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.463 ' O ' ' C ' ' A' ' 9' ' ' GLU . 23.5 t80 -82.64 -15.75 50.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.055 0.455 . . . . 0.0 111.433 -179.368 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.463 ' C ' ' O ' ' A' ' 8' ' ' TYR . 1.9 pt-20 26.57 78.8 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.724 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.417 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 3.7 m-20 165.1 -41.23 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.204 179.513 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -52.16 108.86 1.18 Allowed Pre-proline 0 CA--C 1.535 0.401 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.593 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.615 ' O ' ' N ' ' A' ' 14' ' ' SER . 94.2 Cg_endo -81.57 70.41 7.32 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.179 1.919 . . . . 0.0 112.299 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.577 HG13 HD23 ' A' ' 45' ' ' LEU . 2.6 t 18.85 44.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 123.85 0.719 . . . . 0.0 112.142 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.615 ' N ' ' O ' ' A' ' 12' ' ' PRO . 3.7 p -67.42 -7.58 26.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.512 -179.929 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.494 ' O ' ' C ' ' A' ' 16' ' ' CYS . 30.0 tptt -172.35 -88.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.381 -179.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.5 OUTLIER 26.37 97.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.397 -179.787 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -144.17 1.76 1.11 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.157 -179.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.456 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 10.7 mt -164.24 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.297 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 176.58 109.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.794 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -179.13 -82.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.336 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.452 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 3.3 tp60 -46.45 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.224 -179.414 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.28 -40.18 85.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.523 -179.57 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -53.23 -65.94 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.41 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.563 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -52.24 -42.2 63.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.033 178.882 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.9 m-20 -50.79 -60.73 2.75 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.815 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 28' ' ' LEU . 57.0 m -54.86 -49.9 70.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 178.379 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 17.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.869 179.503 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.517 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.5 tm? -165.47 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.018 -0.673 . . . . 0.0 112.262 -179.395 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.643 ' N ' ' O ' ' A' ' 25' ' ' ASP . 11.0 m-20 -67.77 -11.73 59.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.743 0.306 . . . . 0.0 111.16 -179.507 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 31' ' ' HIS . 24.9 mttm -139.14 27.21 2.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.849 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.597 ' N ' ' CD2' ' A' ' 31' ' ' HIS . 0.0 OUTLIER 34.71 38.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.287 0.565 . . . . 0.0 110.328 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.571 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -83.7 176.75 8.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.814 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.437 ' H ' ' HA ' ' A' ' 51' ' ' TYR . 31.3 ttm180 -92.81 -27.62 17.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 -179.967 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.8 p 177.96 -165.08 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.497 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.77 -176.88 47.58 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.476 -179.982 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -175.49 157.57 2.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.882 0.372 . . . . 0.0 110.962 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -90.7 104.38 16.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.603 -179.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -96.19 171.54 8.54 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.53 ' O ' ' O ' ' A' ' 40' ' ' ASP . 3.5 m-85 -99.11 -8.84 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.626 0.251 . . . . 0.0 111.039 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.53 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.4 OUTLIER 50.43 161.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.0 111.276 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -63.98 8.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.094 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -105.35 -23.72 12.8 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-O 120.9 0.381 . . . . 0.0 110.578 -179.982 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 66.29 52.2 1.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.665 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -139.24 12.22 2.59 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.825 0.345 . . . . 0.0 111.492 -179.641 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.577 HD23 HG13 ' A' ' 13' ' ' VAL . 4.7 tp 64.79 122.36 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.191 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -143.19 155.05 44.45 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.832 179.228 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 98.7 m -98.47 113.13 25.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.981 0.42 . . . . 0.0 112.016 -179.136 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -91.8 117.01 34.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.569 179.607 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.9 m -94.95 112.15 23.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.571 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 3.6 t70 -94.85 154.21 17.35 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.971 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.437 ' HA ' ' H ' ' A' ' 33' ' ' ARG . 66.7 m-85 -131.04 -22.34 2.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.438 -179.017 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.214 0 CA-C-O 120.724 0.297 . . . . 0.0 110.948 -179.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.054 0.455 . . . . 0.0 110.671 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -97.23 121.45 39.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.889 179.859 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.73 126.1 24.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.064 0.459 . . . . 0.0 111.144 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.5 m -62.36 149.52 9.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.014 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' O ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -51.01 -103.44 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.7 179.19 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.454 ' H ' ' HB3' ' A' ' 8' ' ' TYR . 0.7 OUTLIER 178.13 -14.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.378 -0.201 . . . . 0.0 111.484 179.445 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -178.01 21.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.326 . . . . 0.0 110.996 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.491 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 49.8 t80 -56.01 113.54 5.96 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.02 99.23 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.077 1.851 . . . . 0.0 112.256 179.926 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -53.7 92.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.39 179.759 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.556 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 0.6 OUTLIER -175.46 128.5 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.797 -179.702 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 14' ' ' SER . 2.9 tptt 92.62 -13.35 0.17 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.631 -179.82 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m -66.56 70.61 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.728 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' A' ' 15' ' ' LYS . 10.3 mp0 -114.43 -15.62 12.05 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.376 -179.734 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.587 ' N ' HD12 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -162.11 176.27 10.87 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.93 0.395 . . . . 0.0 110.349 -179.843 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -56.7 -149.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.639 -179.837 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 61.55 -79.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.262 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.491 ' OE1' ' OH ' ' A' ' 11' ' ' TYR . 7.8 tp-100 -41.18 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.153 -179.645 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 t -59.36 -41.89 90.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.22 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.21 -74.16 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.009 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.539 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -49.33 -40.12 34.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.529 179.92 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 7.7 m-20 -55.64 -65.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.137 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.456 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.9 m -56.33 -35.93 68.17 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.906 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttpp -59.86 2.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.93 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.456 ' H ' ' C ' ' A' ' 26' ' ' CYS . 13.2 tp -165.14 -36.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.0 m-20 -67.86 -14.17 62.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -141.38 16.9 2.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.756 179.677 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.4 m80 53.2 29.11 7.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.62 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.46 -175.61 5.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.634 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -98.41 -50.34 4.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 -179.82 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.0 OUTLIER -141.43 -173.58 3.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.323 179.595 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.457 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . -168.21 166.38 39.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.063 -1.065 . . . . 0.0 113.363 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -177.2 146.68 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.05 138.43 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.993 0.425 . . . . 0.0 111.527 -179.453 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.19 158.1 43.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.644 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.563 ' CE2' ' CD2' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -81.93 155.26 25.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.839 179.77 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.55 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 4.6 p-10 -161.5 58.62 0.28 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.832 0.348 . . . . 0.0 111.688 -179.885 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 19.1 tp10 93.34 -16.86 0.12 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.47 -0.787 . . . . 0.0 111.579 178.685 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.61 -7.53 34.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.234 -179.221 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? 40.11 39.87 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.236 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -143.64 5.58 1.4 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.563 ' CD2' ' CE2' ' A' ' 39' ' ' TYR . 1.0 OUTLIER 71.65 152.67 0.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.192 179.441 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -149.09 137.4 20.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.163 179.483 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 98.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 43.0 mm -89.82 113.29 25.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.2 m -92.36 129.84 38.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.079 0.466 . . . . 0.0 111.231 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -96.13 125.17 40.47 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.689 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -98.92 -27.44 13.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.752 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.8 m . . . . . 0 C--N 1.331 -0.217 0 CA-C-O 121.184 0.516 . . . . 0.0 110.867 179.741 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.53 0.205 0 CA-C-O 120.399 0.142 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -87.7 143.29 27.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.312 0.577 . . . . 0.0 112.037 -178.782 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -147.88 122.16 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.922 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.74 149.89 5.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.477 ' N ' ' O ' ' A' ' 47' ' ' CYS . 0.3 OUTLIER -105.86 76.65 1.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.875 -1.057 . . . . 0.0 108.305 177.719 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 11' ' ' TYR . 1.6 pt-20 -47.63 -94.0 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.689 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -47.18 92.76 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.377 178.877 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.496 ' N ' ' O ' ' A' ' 9' ' ' GLU . 67.1 t80 -177.8 107.29 0.22 Allowed Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.05 -179.099 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.589 ' O ' ' N ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.57 124.36 8.05 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.351 2.034 . . . . 0.0 112.276 179.925 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.662 ' O ' HG12 ' A' ' 13' ' ' VAL . 40.8 t -60.57 45.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.938 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.589 ' N ' ' O ' ' A' ' 12' ' ' PRO . 78.5 p -63.3 -125.86 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.476 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -68.64 151.91 46.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.335 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.464 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -173.27 -32.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.205 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -74.19 38.93 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.608 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 16' ' ' CYS . 27.4 mt -161.91 -102.58 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.828 -179.639 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -179.62 -153.69 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.415 -179.443 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.74 -82.49 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.417 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.479 HE21 ' CA ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -33.82 -76.46 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.475 -179.979 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.91 -52.34 65.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.244 0.545 . . . . 0.0 110.661 179.242 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -78.25 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.32 -179.623 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -44.87 -48.98 11.15 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.832 -179.361 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.451 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 5.0 m-20 -52.88 -65.77 0.5 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.442 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.475 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -57.34 -29.9 64.37 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.52 -179.854 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.84 1.54 0.14 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.071 179.131 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.475 ' H ' ' C ' ' A' ' 26' ' ' CYS . 23.6 tp -162.44 -31.73 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.391 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -68.63 -17.56 64.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.202 0.525 . . . . 0.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -141.93 -1.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.54 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.3 m80 63.73 42.15 6.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.791 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.496 ' HB2' ' CE2' ' A' ' 51' ' ' TYR . . . -89.03 -173.62 4.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 8.1 ttp180 -98.99 -56.5 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.999 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 48.4 p -167.55 135.34 2.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.038 -179.931 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -123.28 -165.13 12.25 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.42 -0.895 . . . . 0.0 114.983 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -176.14 -145.77 0.02 OUTLIER 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.16 -1.02 . . . . 0.0 109.118 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.17 137.55 20.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.655 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.537 ' CD2' ' CD1' ' A' ' 48' ' ' ILE . 19.6 m-85 -142.21 157.07 45.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.304 178.968 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.532 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 17.2 m-85 -72.08 169.3 16.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.433 -179.582 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -162.9 -158.94 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.436 -179.488 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -62.88 -11.26 17.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.828 -179.36 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.591 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -94.62 10.15 35.96 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.084 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 52.33 2.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.983 0.421 . . . . 0.0 111.144 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.804 ' C ' HD23 ' A' ' 45' ' ' LEU . 4.0 m120 -100.88 -136.04 0.31 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.619 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.804 HD23 ' C ' ' A' ' 44' ' ' ASN . 0.2 OUTLIER -152.39 118.47 5.5 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.317 0.579 . . . . 0.0 111.183 179.053 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -97.26 152.03 19.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.548 -179.601 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -78.18 113.38 16.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.665 179.617 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.537 ' CD1' ' CD2' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -101.31 113.0 36.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.739 -179.693 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.3 m -99.11 134.56 41.78 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.338 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.2 t70 -95.2 115.81 27.92 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.849 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.496 ' CE2' ' HB2' ' A' ' 32' ' ' ALA . 96.8 m-85 -103.43 57.0 0.74 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.648 -179.224 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.158 -179.531 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 121.134 0.492 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.05 155.99 43.16 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.791 179.275 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -151.01 110.24 3.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.017 0.437 . . . . 0.0 111.198 -179.698 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.411 HG13 ' H ' ' A' ' 7' ' ' VAL . 1.6 m -66.45 144.84 14.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.239 179.876 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.553 ' O ' ' CG ' ' A' ' 9' ' ' GLU . 1.9 t80 -63.13 -75.52 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.484 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.58 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.3 pp20? 104.26 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 O-C-N 124.649 1.218 . . . . 0.0 112.074 178.466 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.58 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 10.4 t-20 107.89 -12.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.346 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -52.92 113.49 4.65 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.847 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -42.73 112.48 0.27 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.014 1.81 . . . . 0.0 112.101 179.812 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.507 ' O ' ' C ' ' A' ' 14' ' ' SER . 69.4 t -52.7 -70.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.507 ' C ' ' O ' ' A' ' 13' ' ' VAL . 20.6 p 21.28 -95.04 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.669 179.974 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -69.82 108.95 4.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.477 179.667 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.27 57.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -141.54 22.46 2.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.82 179.943 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -167.81 125.87 1.21 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.53 179.947 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.24 99.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.627 -179.785 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.485 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.5 OUTLIER -175.98 -68.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.603 179.293 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.435 HE21 ' C ' ' A' ' 21' ' ' GLN . 2.8 tp60 -47.99 -74.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.873 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.8 t -58.52 -40.52 83.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.181 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -53.49 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 -179.674 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.554 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.37 -45.39 62.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.344 179.998 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -64.48 0.8 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.835 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.446 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.2 m -54.45 -33.61 59.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -61.89 3.37 0.16 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.591 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.446 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.9 OUTLIER -164.35 -27.26 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.531 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -70.02 -29.67 66.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.789 0.328 . . . . 0.0 110.993 -179.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 31' ' ' HIS . 1.8 mtmp? -141.66 40.88 1.71 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.957 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.448 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.4 m80 31.73 44.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.363 179.864 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.12 179.27 6.17 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.92 0.39 . . . . 0.0 111.244 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.416 ' HG3' HH11 ' A' ' 33' ' ' ARG . 34.9 ttm-85 -96.15 -20.31 18.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.984 179.406 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.0 p 177.84 -176.24 0.18 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.241 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.6 167.87 36.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.796 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -177.24 157.21 1.32 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.805 0.336 . . . . 0.0 110.44 179.766 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -89.53 106.16 18.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.43 -179.369 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.454 ' HB2' HD12 ' A' ' 48' ' ' ILE . 30.0 m-85 -107.96 151.28 26.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.897 179.811 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.401 ' CE2' HD22 ' A' ' 45' ' ' LEU . 8.1 m-85 -81.13 177.17 9.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.935 0.398 . . . . 0.0 111.592 -179.76 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 42' ' ' LYS . 1.4 p30 -167.94 95.24 0.42 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.01 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' A' ' 40' ' ' ASP . 14.4 tt0 27.02 32.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.263 -179.908 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.641 ' N ' ' O ' ' A' ' 40' ' ' ASP . 16.9 mtpp -147.19 0.76 0.72 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.24 179.815 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 61.89 0.98 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.022 0.439 . . . . 0.0 110.283 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.59 ' ND2' ' O ' ' A' ' 42' ' ' LYS . 1.9 m120 -92.94 133.35 36.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.152 179.456 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.421 ' H ' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -86.44 117.49 25.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.569 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -100.63 141.45 33.48 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.086 178.653 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.88 94.26 1.41 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.96 0.409 . . . . 0.0 111.42 -179.682 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.454 HD12 ' HB2' ' A' ' 38' ' ' PHE . 5.8 mt -90.13 120.32 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.562 179.58 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.4 m -92.75 114.97 27.68 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 178.927 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.69 135.49 33.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.978 0.418 . . . . 0.0 111.246 -179.254 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.408 ' OH ' ' O ' ' A' ' 30' ' ' LYS . 10.7 m-85 -109.66 -21.84 12.23 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.047 -178.891 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.4 m . . . . . 0 C--N 1.332 -0.177 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.828 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.248 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -96.48 132.86 41.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.16 0.505 . . . . 0.0 111.906 -179.227 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -146.83 134.79 21.41 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.76 179.908 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.478 ' O ' ' OE2' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -65.2 154.75 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.441 -179.919 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.475 ' OH ' ' OD2' ' A' ' 29' ' ' ASP . 1.0 OUTLIER -92.68 85.06 5.13 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.397 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.544 ' O ' ' C ' ' A' ' 10' ' ' ASN . 1.0 OUTLIER -58.1 171.6 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 -178.917 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.544 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 16.02 101.09 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.599 0.562 . . . . 0.0 111.568 -179.389 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.5 OUTLIER 175.91 141.13 0.21 Allowed Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.037 -178.92 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -34.03 80.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.948 2.432 . . . . 0.0 113.07 -179.604 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.62 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.8 p -60.23 -27.06 38.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.448 179.841 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.42 -45.93 90.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.329 -179.39 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.42 82.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.04 0.448 . . . . 0.0 110.614 -179.782 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -173.64 95.08 0.1 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 179.867 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.43 -34.15 3.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.933 179.552 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.458 HD23 ' HA ' ' A' ' 18' ' ' LEU . 7.0 mt -164.69 -175.21 3.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.304 179.852 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.559 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -53.82 177.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.376 -179.963 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 19' ' ' ALA . 0.2 OUTLIER 96.93 -85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.778 179.697 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -50.82 -70.04 0.1 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.699 0.285 . . . . 0.0 111.66 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.558 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.3 t -53.93 -45.15 71.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.17 -179.481 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -55.47 -66.9 0.34 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.061 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.55 -47.44 57.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.817 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.454 ' O ' ' C ' ' A' ' 28' ' ' LEU . 2.2 m-20 -52.67 -51.11 61.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.555 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.643 ' C ' ' H ' ' A' ' 28' ' ' LEU . 87.4 m -57.88 -40.79 81.07 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.585 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -57.46 -0.45 0.06 Allowed 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 177.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.711 ' O ' ' N ' ' A' ' 30' ' ' LYS . 10.1 tp -162.96 -139.39 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.202 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.475 ' OD2' ' OH ' ' A' ' 8' ' ' TYR . 3.7 m-20 65.24 -50.39 0.36 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 -177.16 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.711 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -126.06 -85.97 0.62 Allowed 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.389 175.772 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.578 ' CD2' ' O ' ' A' ' 30' ' ' LYS . 1.3 p80 169.13 54.16 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.41 178.053 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.05 179.73 6.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.799 179.468 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.28 -33.46 12.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.184 0.516 . . . . 0.0 110.482 -179.991 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.6 p -166.42 -162.57 0.53 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.569 -0.742 . . . . 0.0 109.811 179.833 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 177.72 -168.58 40.16 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 119.693 -1.242 . . . . 0.0 113.471 179.847 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.558 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.7 OUTLIER -177.06 -158.54 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -179.921 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.32 144.79 26.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 111.508 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.449 ' O ' ' N ' ' A' ' 46' ' ' GLN . 57.5 m-85 -144.77 159.97 42.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.198 -179.705 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.596 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 3.1 m-85 -84.44 173.97 10.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.683 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -153.85 -171.4 3.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.929 0.395 . . . . 0.0 111.133 -179.769 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -12.93 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.533 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' ' C ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -95.04 25.88 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.887 -179.912 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 29.55 55.2 0.13 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.192 179.566 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 75.6 m-20 -141.8 -125.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.704 179.701 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.543 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -148.78 162.43 39.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.318 . . . . 0.0 110.592 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 38' ' ' PHE . 20.1 mt-30 -148.3 114.57 5.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.704 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -68.52 102.95 1.56 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.453 -179.513 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.6 mm -89.09 114.89 27.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.06 179.304 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.8 m -98.0 119.21 36.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.988 0.423 . . . . 0.0 110.894 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.13 130.02 44.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.176 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -95.56 -21.67 18.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.963 -179.613 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.6 m . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.947 -179.752 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.534 0.343 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.34 148.73 40.17 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.915 0.388 . . . . 0.0 110.355 179.71 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -150.36 125.56 10.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.881 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -65.58 150.13 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-O 120.837 0.351 . . . . 0.0 111.063 179.768 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.503 ' O ' ' O ' ' A' ' 9' ' ' GLU . 30.2 t80 -100.19 -10.92 20.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.214 0.531 . . . . 0.0 110.888 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.563 ' O ' ' C ' ' A' ' 10' ' ' ASN . 2.0 pm0 34.31 -158.04 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.64 -179.576 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.563 ' C ' ' O ' ' A' ' 9' ' ' GLU . 37.2 t-20 2.42 102.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.671 0.607 . . . . 0.0 111.863 -179.719 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.3 OUTLIER 179.97 141.13 0.32 Allowed Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.561 -179.197 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -40.03 90.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.232 1.955 . . . . 0.0 112.409 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.639 ' O ' ' N ' ' A' ' 15' ' ' LYS . 54.7 t -52.87 -90.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.361 179.863 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.496 ' C ' ' O ' ' A' ' 13' ' ' VAL . 60.7 p 9.96 -70.21 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.864 0.728 . . . . 0.0 112.866 179.206 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -60.28 89.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.997 -179.546 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 116.92 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.356 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -114.15 -54.16 2.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.569 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.447 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 1.4 mt -174.2 -20.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.918 179.467 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.447 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 178.7 104.24 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.631 -179.693 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.565 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -175.64 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.163 179.709 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.439 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 30.7 mm100 -50.71 -52.05 43.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.802 -179.772 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.65 -59.29 5.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 179.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.528 HD22 ' C ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -49.8 -63.68 1.04 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.57 -179.833 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -48.7 69.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.312 179.564 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 29' ' ' ASP . 23.7 m-20 -49.24 -65.14 0.62 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.5 179.816 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 28' ' ' LEU . 62.7 m -49.93 -41.99 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.326 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -61.0 10.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.659 179.169 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 26' ' ' CYS . 11.3 tp -163.14 -30.1 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.684 0.278 . . . . 0.0 111.711 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -70.0 -61.35 1.81 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.345 179.776 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.84 19.17 14.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 53.2 32.94 14.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 -179.31 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.601 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -84.28 -177.35 6.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.784 -179.431 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.0 -42.06 8.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.767 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.3 p -154.85 -156.44 0.67 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.842 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 171.2 -175.91 44.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.569 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -177.78 155.82 1.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.459 ' SG ' ' O ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -87.43 155.48 20.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.876 0.369 . . . . 0.0 110.899 179.99 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -146.65 121.13 9.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.808 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.662 ' CE1' HD21 ' A' ' 45' ' ' LEU . 34.8 m-85 -70.87 -93.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.245 179.555 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.54 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER 53.94 147.65 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.499 0.666 . . . . 0.0 111.694 179.409 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.54 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 2.6 tt0 89.62 -79.22 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.728 178.299 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.63 73.65 1.19 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.201 -178.792 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.58 38.78 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.296 179.314 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.634 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 54.1 m-80 -92.77 -163.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.132 179.76 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.662 HD21 ' CE1' ' A' ' 39' ' ' TYR . 9.2 mt -155.23 98.22 1.98 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.786 0.327 . . . . 0.0 111.266 179.984 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.459 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 78.1 mt-30 -94.79 170.51 9.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.018 179.148 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.8 109.46 15.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.042 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mm -92.68 121.62 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.55 179.367 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.93 122.58 43.07 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.647 0.26 . . . . 0.0 110.63 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.601 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.1 OUTLIER -93.85 141.63 28.29 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.91 0.386 . . . . 0.0 110.63 -179.996 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -114.75 -12.83 12.1 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.907 -179.102 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.242 0 CA-C-O 120.624 0.25 . . . . 0.0 111.374 -179.388 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.138 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -95.42 135.92 36.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 113.83 7.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.998 0.427 . . . . 0.0 111.331 -179.434 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.445 HG13 ' H ' ' A' ' 7' ' ' VAL . 0.8 OUTLIER -65.3 135.93 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.458 179.228 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.531 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -64.82 106.61 1.25 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.902 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 10' ' ' ASN . 8.5 mt-10 -63.06 43.16 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.324 -178.785 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 8' ' ' TYR . 1.3 m120 172.42 -97.75 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.561 179.878 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.519 ' C ' ' O ' ' A' ' 10' ' ' ASN . 8.2 t80 8.52 76.37 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.423 0 O-C-N 123.733 0.645 . . . . 0.0 112.63 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.542 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.6 Cg_exo -62.66 109.66 0.94 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.985 2.457 . . . . 0.0 112.026 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.555 ' O ' ' CB ' ' A' ' 14' ' ' SER . 21.6 t 8.75 -108.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 O-C-N 123.845 0.716 . . . . 0.0 112.039 179.946 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 13' ' ' VAL . 5.1 p 91.33 -45.15 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.754 0.312 . . . . 0.0 111.457 179.124 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -172.56 74.94 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.977 0.418 . . . . 0.0 110.874 -178.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -66.44 -59.9 3.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.893 -179.689 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.596 ' O ' ' N ' ' A' ' 19' ' ' ALA . 0.9 OUTLIER 61.5 10.81 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.738 179.207 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.482 HD12 ' N ' ' A' ' 18' ' ' LEU . 6.5 mp 30.79 30.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' A' ' 17' ' ' GLN . . . 175.99 35.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.732 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER -166.47 -141.29 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.518 179.537 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.548 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER 2.62 -69.37 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 124.008 0.817 . . . . 0.0 111.981 179.721 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.586 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.1 t -58.94 -65.71 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.023 179.57 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' ASN . 44.4 t-20 -51.29 -54.81 22.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.958 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -54.33 -44.63 72.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.137 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 78.6 m-20 -57.28 -64.79 0.77 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.219 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.479 ' C ' ' H ' ' A' ' 28' ' ' LEU . 58.1 m -52.78 -51.46 60.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.742 179.846 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -59.72 10.55 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.816 -179.799 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.479 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.82 -52.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 119.998 -0.681 . . . . 0.0 112.72 -179.495 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.5 OUTLIER -66.72 -7.57 21.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.578 0.228 . . . . 0.0 111.474 -179.12 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.409 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -141.81 24.84 2.01 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.952 0.406 . . . . 0.0 110.378 179.448 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.7 m80 38.46 38.91 0.27 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.037 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.16 -176.35 5.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.827 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -95.85 -45.27 7.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.384 179.825 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.474 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 2.7 p -168.93 130.96 1.24 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.92 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -101.98 174.88 24.71 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.33 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -174.92 138.31 0.46 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.982 0.42 . . . . 0.0 110.583 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.2 m -89.48 113.12 24.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.416 -179.453 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.623 ' CD1' HD12 ' A' ' 48' ' ' ILE . 18.7 m-85 -97.98 141.54 30.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.423 179.297 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.494 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 9.5 m-85 -83.26 -169.67 2.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.936 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.562 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 2.9 p-10 -173.59 156.03 2.87 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.346 0.593 . . . . 0.0 112.04 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.464 ' C ' ' O ' ' A' ' 40' ' ' ASP . 21.9 mt-10 16.92 -82.27 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.103 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.9 mptt -91.64 60.87 4.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.232 0.539 . . . . 0.0 110.943 -178.917 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.467 ' C ' ' O ' ' A' ' 42' ' ' LYS . 28.3 mmt180 29.04 60.44 0.14 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.584 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.689 ' C ' HD12 ' A' ' 45' ' ' LEU . 0.6 OUTLIER -95.39 -154.53 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.792 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.689 HD12 ' C ' ' A' ' 44' ' ' ASN . 5.7 mp -155.23 140.73 17.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.844 0.354 . . . . 0.0 110.995 179.545 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -143.05 131.81 22.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.252 179.834 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.66 101.73 4.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.358 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.623 HD12 ' CD1' ' A' ' 38' ' ' PHE . 15.7 mt -95.84 114.31 32.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.474 178.194 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.409 ' SG ' ' NZ ' ' A' ' 30' ' ' LYS . 91.7 m -94.73 118.8 32.32 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.301 179.364 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.1 t0 -94.45 118.3 31.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.452 0.644 . . . . 0.0 111.212 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -99.21 -89.65 0.31 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.029 179.6 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.4 m . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.032 179.53 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.806 0.336 . . . . 0.0 110.752 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.92 97.01 3.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.411 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.4 mttt -93.72 107.22 19.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.897 0.38 . . . . 0.0 111.36 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.42 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.1 m -66.55 130.7 32.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.719 179.873 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.546 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -74.27 58.58 0.73 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.069 0.461 . . . . 0.0 110.442 179.504 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.567 ' O ' ' N ' ' A' ' 11' ' ' TYR . 7.1 mt-10 26.2 -153.61 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.442 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -60.16 56.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.611 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.567 ' N ' ' O ' ' A' ' 9' ' ' GLU . 42.8 t80 -50.69 140.97 18.41 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.414 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.409 ' HD2' ' CG ' ' A' ' 11' ' ' TYR . 17.0 Cg_endo -57.29 92.48 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 -179.68 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.0 t -53.88 105.88 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.185 -179.622 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 p -176.33 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.05 179.98 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.571 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 16.2 mmmt -66.02 136.39 55.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.108 179.169 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.571 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.5 m -170.11 -64.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.616 0.246 . . . . 0.0 111.492 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.477 ' C ' ' O ' ' A' ' 16' ' ' CYS . 1.7 mm-40 -28.14 -38.8 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.408 -179.478 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 16' ' ' CYS . 1.1 mp -70.65 -120.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.19 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.45 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -179.65 -20.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.248 0.547 . . . . 0.0 111.631 -179.736 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.479 ' O ' ' C ' ' A' ' 21' ' ' GLN . 1.2 t-20 -47.62 -106.38 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.847 -178.93 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.479 ' C ' ' O ' ' A' ' 20' ' ' ASN . 13.7 mm-40 -25.26 -60.22 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.309 -179.131 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -54.04 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.937 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 2.5 t-20 -48.73 -54.83 13.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.901 -179.324 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -52.29 -55.83 18.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.648 179.907 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 96.8 m-20 -50.74 -55.16 17.99 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.262 -179.619 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.0 m -54.85 -45.9 74.61 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.938 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -61.44 11.84 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.531 -0.758 . . . . 0.0 112.223 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.7 tt -165.02 -47.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.294 -0.562 . . . . 0.0 112.261 -179.469 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 92.4 m-20 -66.7 -11.27 53.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.133 0.492 . . . . 0.0 110.169 179.789 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.427 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 36.0 mmtm -141.72 5.37 1.77 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.038 179.427 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.427 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 41.17 46.05 2.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.737 -179.866 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.32 -173.7 4.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.917 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.12 -23.59 18.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.291 0.567 . . . . 0.0 109.698 179.541 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -177.64 -168.44 0.18 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.993 179.702 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.468 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . 166.95 170.26 31.6 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.929 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -179.31 -179.97 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.732 0.301 . . . . 0.0 110.259 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 39.1 m -88.61 88.82 7.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.266 179.391 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.524 ' HB2' HD12 ' A' ' 48' ' ' ILE . 42.9 m-85 -91.72 159.06 16.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.834 -179.734 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.565 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 5.0 m-85 -83.77 166.26 18.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.008 179.926 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.538 ' CG ' HE22 ' A' ' 46' ' ' GLN . 6.3 p-10 -129.19 -173.15 2.91 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.047 -179.532 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.52 2.06 0.19 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.29 -179.656 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -95.61 -63.89 1.11 Allowed 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.391 179.777 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.557 ' HB2' ' O ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 139.78 5.08 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.225 1.41 . . . . 0.0 109.734 179.397 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.917 ' O ' HD23 ' A' ' 45' ' ' LEU . 0.4 OUTLIER -90.96 -140.63 0.16 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.882 0.372 . . . . 0.0 111.302 -179.518 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.917 HD23 ' O ' ' A' ' 44' ' ' ASN . 0.2 OUTLIER -147.32 149.16 32.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 -179.597 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.538 HE22 ' CG ' ' A' ' 40' ' ' ASP . 3.5 mp0 -148.83 136.78 20.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.674 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.424 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -66.18 87.19 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.768 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.524 HD12 ' HB2' ' A' ' 38' ' ' PHE . 9.7 mt -86.57 124.07 40.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.047 0.451 . . . . 0.0 111.627 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.7 m -93.12 110.68 22.18 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.202 178.442 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.62 130.5 37.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.37 0.605 . . . . 0.0 112.084 -178.509 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -100.01 -42.04 6.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.24 179.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.169 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.296 -179.473 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.44 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.8 m . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 120.866 0.365 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 138.32 24.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.743 0.306 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -143.76 114.65 7.76 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.539 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.44 ' O ' HG23 ' A' ' 7' ' ' VAL . 2.7 m -66.53 127.82 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.047 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -85.19 80.09 9.33 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.312 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -57.29 -70.38 0.13 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.398 0.618 . . . . 0.0 110.042 -179.003 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 60.0 t-20 -51.92 86.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.707 178.964 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.618 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.7 t80 -177.8 97.34 0.22 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.452 -179.027 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.537 ' O ' ' C ' ' A' ' 13' ' ' VAL . 79.8 Cg_exo -45.94 75.65 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.814 2.342 . . . . 0.0 112.978 -179.574 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.618 ' N ' ' O ' ' A' ' 11' ' ' TYR . 15.9 t -7.86 -62.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 O-C-N 123.798 0.686 . . . . 0.0 112.52 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.565 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 67.4 p 27.23 -92.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.481 -179.82 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.565 ' N ' ' OG ' ' A' ' 14' ' ' SER . 0.1 OUTLIER -68.9 156.49 38.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.54 -179.624 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 1.7 m -172.59 -37.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.73 52.04 1.39 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.298 0.571 . . . . 0.0 109.785 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.4 mt -161.95 96.24 1.0 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.282 -179.215 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.18 78.74 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.737 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.566 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER -162.01 -79.14 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.292 179.847 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.51 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -22.75 -86.16 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.347 179.844 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.487 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 1.9 m -57.55 -52.38 65.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.163 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.84 -75.18 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.573 -179.103 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.566 ' N ' ' O ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -48.94 -57.13 6.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.724 -179.077 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 29' ' ' ASP . 34.6 m-20 -52.11 -56.44 14.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.336 -179.453 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.527 ' C ' ' H ' ' A' ' 28' ' ' LEU . 94.9 m -50.44 -53.06 32.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.029 0.442 . . . . 0.0 110.064 179.834 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -61.99 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.335 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.4 tt -163.68 -40.82 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -179.759 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -67.2 -40.07 86.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.754 0.312 . . . . 0.0 110.764 -179.707 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -112.72 15.49 19.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.544 179.486 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.7 m170 52.04 44.37 29.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.852 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.61 -154.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.896 0.379 . . . . 0.0 111.121 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.2 mtp85 -142.52 -2.99 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.831 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.3 p -175.32 -179.83 1.38 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.728 -179.94 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 156.73 167.95 18.68 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.337 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -178.51 174.99 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.903 0.382 . . . . 0.0 110.901 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -86.54 133.9 33.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.1 179.661 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -144.98 148.6 33.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.057 0.456 . . . . 0.0 111.44 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -75.44 -179.73 4.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.456 -179.531 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.517 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -154.85 -179.86 8.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.072 179.9 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -61.4 0.62 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.946 0.403 . . . . 0.0 110.462 -179.979 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.517 ' H ' ' C ' ' A' ' 40' ' ' ASP . 25.4 mtmm -102.2 -12.65 17.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.164 -179.886 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.477 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 15.7 ttp180 83.16 -5.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -95.6 156.13 16.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.435 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.8 mp -91.44 157.4 17.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.037 0.446 . . . . 0.0 111.775 -179.568 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -146.03 143.7 29.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.786 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.2 m -79.34 97.96 6.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.7 mt -87.06 126.09 40.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.9 m -98.84 111.75 24.05 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.955 179.421 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -95.22 131.64 41.05 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -103.98 -37.01 7.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.862 -179.281 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.44 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 1.4 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.706 -178.819 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 121.036 0.446 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 116.27 8.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.504 179.535 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.405 ' NZ ' ' OH ' ' A' ' 51' ' ' TYR . 11.2 pttm -152.46 135.99 16.04 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.253 -0.579 . . . . 0.0 112.1 -178.977 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.55 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -67.23 150.85 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.582 179.228 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.674 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -64.28 61.6 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.462 179.813 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 7' ' ' VAL . 2.8 mt-10 16.76 -140.65 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.38 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.78 12.52 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -178.202 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.623 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 67.3 t80 -50.98 143.11 16.14 Favored Pre-proline 0 N--CA 1.467 0.387 0 O-C-N 121.952 -0.468 . . . . 0.0 109.786 179.597 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.756 ' O ' HG23 ' A' ' 13' ' ' VAL . 9.4 Cg_endo -48.16 -88.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.876 1.717 . . . . 0.0 112.179 -179.596 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.756 HG23 ' O ' ' A' ' 12' ' ' PRO . 71.0 t 117.47 -8.12 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.638 1.175 . . . . 0.0 110.728 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 p -66.28 25.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.24 179.69 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.611 ' H ' ' C ' ' A' ' 13' ' ' VAL . 0.6 OUTLIER -172.02 99.57 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.96 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -171.25 27.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.815 -179.097 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.513 ' N ' ' CD ' ' A' ' 17' ' ' GLN . 1.7 mm100 -76.16 17.23 0.36 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.768 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' A' ' 16' ' ' CYS . 7.1 mt -163.42 -90.29 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.972 -179.848 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.92 -150.97 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.147 0.499 . . . . 0.0 110.995 -179.082 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.552 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.1 OUTLIER 67.0 -75.47 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.914 179.899 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.552 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 4.8 tp-100 -38.13 -83.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 -179.667 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.623 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -57.68 -40.74 80.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 110.737 179.416 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.411 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -56.66 -76.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.865 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.28 -40.38 24.67 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.845 179.946 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.439 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 65.6 m-20 -55.04 -68.52 0.18 Allowed 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.055 -179.787 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.674 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -54.52 -39.33 67.51 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.793 179.824 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? -60.77 6.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.088 179.723 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.486 ' H ' ' C ' ' A' ' 26' ' ' CYS . 17.4 tp -163.38 -36.77 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.546 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -67.68 -13.34 62.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.068 0.461 . . . . 0.0 110.351 -179.918 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -141.31 8.85 2.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.074 179.398 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 56.8 50.69 12.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.959 179.925 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.85 173.8 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.764 179.83 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -93.39 -51.2 5.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.294 179.886 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.3 p -160.96 126.57 3.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 179.871 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.411 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . -132.15 167.57 22.86 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.878 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -176.76 161.18 2.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.358 0.599 . . . . 0.0 111.003 -179.885 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -86.94 128.32 35.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.764 -179.737 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -125.62 148.75 48.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.043 0.449 . . . . 0.0 111.109 -179.725 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.625 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 25.2 m-85 -99.26 152.6 19.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.131 179.444 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 44' ' ' ASN . 0.3 OUTLIER -95.92 172.63 7.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.176 179.147 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -61.66 -2.02 0.71 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.035 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.434 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -97.59 -80.06 0.45 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.301 179.384 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.05 21.59 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.463 179.601 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.625 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -95.26 -165.1 1.24 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.767 0.318 . . . . 0.0 111.197 -179.964 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.551 HD11 ' CZ ' ' A' ' 39' ' ' TYR . 1.4 mt -146.22 147.06 31.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 0.0 111.057 -179.5 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -148.75 125.4 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 65.9 m -77.74 95.91 4.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.819 -179.92 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.436 HD13 HG12 ' A' ' 7' ' ' VAL . 3.3 mm -83.77 114.61 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.95 -179.428 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.5 m -106.04 111.84 24.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.317 178.984 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -96.82 153.85 17.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.064 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.405 ' OH ' ' NZ ' ' A' ' 6' ' ' LYS . 37.8 m-85 -121.06 -25.95 5.23 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.966 -178.889 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.465 0.281 0 CA-C-O 120.872 0.367 . . . . 0.0 111.245 -179.71 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.416 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.2 m . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 121.144 0.497 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 tptm -98.43 132.06 44.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.536 179.686 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -149.26 117.42 6.39 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.887 0.375 . . . . 0.0 111.516 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.4 143.41 15.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.16 -179.908 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.407 ' CD1' ' NZ ' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -86.34 109.42 18.98 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.025 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.505 ' O ' ' O ' ' A' ' 10' ' ' ASN . 2.5 mt-10 -55.1 -174.79 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.477 -178.916 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.505 ' O ' ' O ' ' A' ' 9' ' ' GLU . 5.5 p30 17.57 104.6 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.855 0.722 . . . . 0.0 111.923 -179.575 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.532 ' C ' ' H ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -179.86 81.57 0.19 Allowed Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.272 -179.636 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.52 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 52.7 Cg_exo -56.79 5.93 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 123.235 2.624 . . . . 0.0 113.822 -178.793 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.532 ' H ' ' C ' ' A' ' 11' ' ' TYR . 90.7 t 101.87 -72.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.201 1.001 . . . . 0.0 111.505 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.491 ' C ' ' O ' ' A' ' 13' ' ' VAL . 7.0 p 27.72 89.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 14' ' ' SER . 1.0 OUTLIER 92.86 -123.63 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.426 -179.426 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER 78.94 -49.18 0.43 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.528 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.88 -12.88 8.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.082 0.468 . . . . 0.0 110.659 -179.568 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.628 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 0.8 OUTLIER -71.82 -45.08 62.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.094 179.885 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 101.98 3.86 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 O-C-N 123.773 0.67 . . . . 0.0 110.802 -179.619 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.595 ' O ' ' N ' ' A' ' 22' ' ' CYS . 5.3 t-20 -97.03 -118.24 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.744 179.81 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 20' ' ' ASN . 14.7 mm100 -1.14 -65.31 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.952 0.782 . . . . 0.0 112.326 179.677 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.4 t -57.11 -69.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.93 179.887 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.41 ' N ' ' O ' ' A' ' 20' ' ' ASN . 25.0 t30 -50.45 -51.06 50.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.27 179.933 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.49 -47.31 76.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.64 179.367 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.429 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 97.3 m-20 -57.19 -55.3 36.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.871 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.888 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 57.0 m -56.06 -47.57 77.68 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.869 179.724 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.86 8.83 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.112 178.902 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.673 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -162.79 -132.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.677 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.558 ' H ' HD13 ' A' ' 28' ' ' LEU . 1.6 m-20 39.85 -77.2 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.461 0.476 . . . . 0.0 111.897 -179.889 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.673 ' N ' ' O ' ' A' ' 28' ' ' LEU . 12.6 mttp -91.99 -4.91 53.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.719 0.295 . . . . 0.0 110.981 -179.769 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.526 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.6 OUTLIER 82.99 44.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.642 179.391 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.888 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -88.0 172.7 9.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.26 179.276 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -95.73 -29.25 14.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.009 0.433 . . . . 0.0 110.49 179.921 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.7 p -174.54 -164.67 0.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.653 179.882 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 168.54 -178.5 42.01 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.348 -179.909 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -178.22 160.7 1.38 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.868 0.366 . . . . 0.0 110.622 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 137.27 32.48 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.566 -179.81 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -146.39 131.78 18.61 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.147 0.499 . . . . 0.0 112.202 -179.405 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.535 ' CZ ' ' O ' ' A' ' 43' ' ' ARG . 1.2 m-85 -39.04 163.51 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.598 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 44' ' ' ASN . 19.5 p30 -136.87 -161.76 1.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.192 179.504 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -63.1 -28.33 70.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.146 -179.664 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 24.0 mmmt -99.67 28.17 4.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.186 -179.794 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.535 ' O ' ' CZ ' ' A' ' 39' ' ' TYR . 28.8 mtm180 59.74 5.8 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.433 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 73.2 m-80 -94.96 145.94 24.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.968 0.413 . . . . 0.0 111.215 -179.7 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.743 ' H ' HD23 ' A' ' 45' ' ' LEU . 0.3 OUTLIER -91.34 120.79 32.52 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -178.622 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -98.61 148.57 23.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.542 178.306 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -78.58 98.14 6.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.629 -179.383 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.4 mt -87.83 116.73 30.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.25 179.397 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.6 m -96.52 120.89 37.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 179.924 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.418 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 5.8 t70 -97.25 134.59 40.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.359 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -104.65 -28.43 11.23 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.667 -178.943 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.416 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 0.0 111.384 -179.495 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.432 0.158 . . . . 0.0 111.044 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.481 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -140.47 151.14 44.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.939 0.4 . . . . 0.0 111.8 -179.363 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -148.89 133.75 17.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.504 -179.771 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.8 m -65.66 139.75 20.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.649 179.778 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.474 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -81.51 54.33 2.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.859 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.609 ' O ' ' N ' ' A' ' 11' ' ' TYR . 13.1 mt-10 25.22 -145.59 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.784 -179.968 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -57.62 58.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.104 -179.51 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.609 ' N ' ' O ' ' A' ' 9' ' ' GLU . 35.4 t80 -56.19 121.33 41.16 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 110.513 -0.18 . . . . 0.0 110.513 179.424 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -41.02 90.12 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.547 1.498 . . . . 0.0 111.292 179.096 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.537 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -51.45 95.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.222 0.534 . . . . 0.0 111.11 -179.276 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 91.0 p -175.25 130.66 0.29 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.54 -179.903 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.498 ' O ' ' C ' ' A' ' 16' ' ' CYS . 26.8 mttt 87.96 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.764 0.665 . . . . 0.0 110.919 -179.537 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.498 ' C ' ' O ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER 25.2 98.01 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.344 0.403 . . . . 0.0 111.282 179.953 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.426 ' O ' ' C ' ' A' ' 18' ' ' LEU . 31.7 mt-30 -120.65 50.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 -179.981 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.617 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 26.1 mt 36.5 89.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.909 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 103.28 149.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 124.107 0.879 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.608 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.2 OUTLIER 84.46 -68.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 179.547 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.608 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 6.7 mm-40 -49.43 -79.06 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.672 0.272 . . . . 0.0 111.011 -179.542 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.1 m -55.23 -39.17 69.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.916 0.388 . . . . 0.0 110.52 179.956 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -55.65 -81.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.594 179.45 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.72 -46.8 30.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.232 -179.855 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.444 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 3.6 m-20 -51.82 -66.53 0.37 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.461 0.172 . . . . 0.0 110.93 -179.66 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.554 ' C ' ' H ' ' A' ' 28' ' ' LEU . 28.8 m -55.36 -36.54 66.44 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.384 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -60.48 6.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.17 179.297 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.554 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.5 tp -159.64 -34.16 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.288 -179.384 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -70.61 -56.82 5.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.004 0.43 . . . . 0.0 110.111 179.293 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 2.1 mptt -102.61 21.3 15.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.336 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.4 p80 35.43 45.17 0.21 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.154 0.502 . . . . 0.0 110.796 -179.943 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.09 -132.79 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.608 179.798 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -139.32 -31.12 0.7 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.294 179.382 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.2 p -167.33 -164.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.796 -179.931 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.09 -171.31 44.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -177.15 154.33 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.852 0.358 . . . . 0.0 110.983 -179.969 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 92.2 m -85.52 96.71 9.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.566 179.976 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.419 ' HB2' HD12 ' A' ' 48' ' ' ILE . 37.0 m-85 -108.12 163.0 13.54 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.194 -179.872 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.57 ' CE2' HD23 ' A' ' 45' ' ' LEU . 27.5 m-85 -87.03 -22.77 25.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.769 179.745 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.506 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.1 OUTLIER 48.0 171.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.803 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.74 39.58 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.469 -179.681 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.489 ' H ' ' C ' ' A' ' 40' ' ' ASP . 16.2 mtmt -144.64 -1.76 0.88 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.563 -179.666 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 41.76 65.91 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.233 0.539 . . . . 0.0 109.934 -179.515 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -138.94 0.97 2.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.325 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.57 HD23 ' CE2' ' A' ' 39' ' ' TYR . 1.1 tm? 51.63 63.86 2.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.012 0.434 . . . . 0.0 110.377 179.218 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -95.03 169.86 9.82 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.418 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -96.69 114.58 26.23 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.404 -179.753 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.419 HD12 ' HB2' ' A' ' 38' ' ' PHE . 23.4 mt -90.6 132.09 36.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.542 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.9 m -100.95 112.86 25.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.753 179.482 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.603 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 6.8 t70 -94.09 151.94 19.13 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.726 179.829 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -124.0 -29.3 3.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.251 -178.783 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 35.1 m . . . . . 0 N--CA 1.463 0.193 0 CA-C-O 120.766 0.317 . . . . 0.0 111.143 -179.588 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 93.4 m . . . . . 0 N--CA 1.456 -0.157 0 CA-C-O 120.904 0.383 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' CD ' ' A' ' 5' ' ' LYS . 2.5 tmtt? -145.94 131.46 18.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.13 114.26 5.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.07 -179.949 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.417 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.0 OUTLIER -64.67 130.95 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.304 179.956 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.531 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -71.59 64.26 0.44 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.03 0.443 . . . . 0.0 110.344 179.781 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' N ' ' A' ' 11' ' ' TYR . 3.4 mt-10 29.26 -156.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.147 179.366 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.44 47.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.386 -179.315 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.605 ' O ' ' O ' ' A' ' 12' ' ' PRO . 58.2 t80 -52.25 145.3 19.45 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.183 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.605 ' O ' ' O ' ' A' ' 11' ' ' TYR . 73.8 Cg_exo -49.58 -139.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.895 1.73 . . . . 0.0 112.597 179.863 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.587 ' C ' ' H ' ' A' ' 15' ' ' LYS . 0.5 OUTLIER -179.26 -19.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.743 179.852 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.3 p -64.24 19.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -179.906 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.587 ' H ' ' C ' ' A' ' 13' ' ' VAL . 1.7 tttm -173.89 104.76 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.925 0.393 . . . . 0.0 111.502 -179.909 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.84 110.89 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.072 179.424 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -127.46 -54.02 1.35 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.822 -179.649 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.679 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 0.4 OUTLIER -179.31 89.44 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.794 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 96.71 174.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.491 0.662 . . . . 0.0 112.62 178.219 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.89 -78.31 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.819 179.265 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -39.04 -85.03 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.581 -179.051 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.8 m -58.15 -40.39 81.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.701 -179.346 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -52.98 -70.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.529 -179.506 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.572 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.55 -54.61 25.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.705 0.288 . . . . 0.0 111.114 -179.551 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.516 ' O ' ' N ' ' A' ' 29' ' ' ASP . 29.9 m-20 -49.57 -60.69 2.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.926 -179.514 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 37.9 m -54.98 -32.7 61.83 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.97 179.65 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.24 0.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.318 179.512 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -165.05 -37.12 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 -179.204 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.516 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -65.84 -16.87 64.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.767 0.318 . . . . 0.0 111.101 -179.314 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mmtt -142.6 5.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.967 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.8 36.9 19.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.767 179.897 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.38 -169.76 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.387 -179.744 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.434 ' H ' ' HA ' ' A' ' 51' ' ' TYR . 8.4 tpm_? -97.85 -20.9 17.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.655 179.992 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p 171.31 -163.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.334 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.65 -175.22 46.28 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.589 179.901 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -175.81 158.48 2.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 0.0 110.407 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 3.8 m -87.52 130.53 34.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.49 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -149.21 165.84 30.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.776 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.611 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.3 m-85 -81.88 166.86 19.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.35 179.705 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -124.38 87.08 2.66 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.162 0.506 . . . . 0.0 111.035 179.956 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' A' ' 40' ' ' ASP . 59.1 mt-10 21.25 41.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.5 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.605 ' N ' ' O ' ' A' ' 40' ' ' ASP . 5.0 ttmm -147.13 -76.47 0.18 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.949 0.404 . . . . 0.0 110.979 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 162.71 58.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.558 -179.959 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.611 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 20.2 m-80 -141.01 -164.05 1.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.337 -179.684 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.3 tp -152.64 82.77 1.23 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.857 -179.656 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -92.33 165.63 12.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.21 -179.73 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.0 110.47 22.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.342 -179.696 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.575 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.9 mp -89.22 122.25 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.209 179.541 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -93.57 113.39 25.49 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.902 0.382 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -95.2 139.83 30.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.889 -179.819 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.434 ' HA ' ' H ' ' A' ' 33' ' ' ARG . 67.6 m-85 -106.95 -11.95 15.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.167 -179.62 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 56.5 m . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.263 -179.448 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.911 0.386 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.4 122.56 40.58 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.905 179.12 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -148.78 144.49 27.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 111.206 -179.064 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.509 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 21.7 m -62.24 162.25 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 CA-C-O 121.165 0.507 . . . . 0.0 111.068 179.52 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.539 ' CD1' ' C ' ' A' ' 8' ' ' TYR . 3.5 p90 -67.71 -29.56 68.84 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.799 -179.653 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.548 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER 26.81 101.87 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.538 -177.458 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.548 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 49.3 m-20 104.91 79.76 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.832 179.903 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.55 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.7 t80 170.42 96.47 0.04 OUTLIER Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.512 179.125 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.579 ' O ' ' N ' ' A' ' 14' ' ' SER . 96.1 Cg_exo -44.86 112.1 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.208 1.938 . . . . 0.0 112.399 -179.996 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.59 73.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.429 -179.838 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.579 ' N ' ' O ' ' A' ' 12' ' ' PRO . 9.2 p -63.79 -24.4 67.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.634 179.641 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -173.48 165.11 4.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.159 179.645 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -173.42 10.37 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -89.0 -33.44 17.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 0.0 110.719 179.863 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.58 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 3.3 mt -70.89 -58.61 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.547 -179.941 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.58 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 105.35 59.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.884 0.74 . . . . 0.0 110.974 -179.256 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.775 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.5 OUTLIER -155.35 -51.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.702 179.695 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.775 ' N ' HD22 ' A' ' 20' ' ' ASN . 0.9 OUTLIER -47.93 -76.74 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.475 179.926 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.55 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -59.74 -42.38 93.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.734 0.302 . . . . 0.0 110.939 179.789 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.599 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 2.7 t-20 -54.7 -76.97 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.106 179.883 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.95 -37.81 21.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.346 179.832 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.598 ' O ' ' N ' ' A' ' 29' ' ' ASP . 68.0 m-20 -55.5 -69.58 0.13 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.655 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.52 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -51.66 -38.16 53.65 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.904 179.828 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.408 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 3.5 mtpt -57.93 3.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.117 179.368 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.52 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.01 -43.64 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.864 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.598 ' N ' ' O ' ' A' ' 25' ' ' ASP . 84.2 m-20 -68.17 -8.08 35.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.699 0.285 . . . . 0.0 111.301 -179.429 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -140.29 13.32 2.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.779 179.925 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 22.0 m170 59.94 38.17 21.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.977 179.321 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.49 -166.13 1.52 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.649 179.181 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.408 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 46.7 ttt180 -129.54 -48.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.972 0.415 . . . . 0.0 110.448 179.558 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.447 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 1.1 p -158.53 124.39 4.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.268 179.531 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.599 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . -130.18 -176.53 14.46 Favored Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.38 -0.914 . . . . 0.0 113.649 -179.234 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -174.93 158.77 2.59 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.537 0.208 . . . . 0.0 110.776 179.929 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 139.03 30.93 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.606 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -149.29 154.34 38.87 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.511 ' HB3' HD12 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -163.52 172.58 14.22 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.902 -179.43 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.524 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -139.4 -160.65 1.09 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.818 0.342 . . . . 0.0 111.241 -178.964 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.473 ' CG ' ' O ' ' A' ' 41' ' ' GLU . 38.5 tt0 -60.05 3.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.115 -179.417 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.541 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.3 OUTLIER -94.18 4.65 53.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.233 0.539 . . . . 0.0 109.925 179.48 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 46.33 10.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.015 -179.8 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.541 ' H ' ' C ' ' A' ' 42' ' ' LYS . 10.5 m120 -94.68 97.19 9.91 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.143 0.497 . . . . 0.0 110.274 179.462 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.511 HD12 ' HB3' ' A' ' 39' ' ' TYR . 6.4 tp -89.47 130.31 35.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.677 -178.942 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -137.28 154.57 50.08 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.152 -179.009 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -92.94 111.78 23.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.33 179.834 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.5 mm -80.46 109.94 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.365 179.059 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 m -96.87 115.35 27.27 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.47 0.481 . . . . 0.0 110.721 -179.444 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' A' ' 34' ' ' SER . 1.0 OUTLIER -95.24 131.83 40.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.176 -179.67 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -101.9 -17.4 16.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.178 -179.42 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.489 -179.977 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.489 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.5 m . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.543 0.211 . . . . 0.0 110.938 . . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.7 137.77 32.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.481 -179.606 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -149.22 123.01 9.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.497 179.681 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.15 142.63 16.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -81.26 103.16 10.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.435 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.54 ' O ' ' C ' ' A' ' 10' ' ' ASN . 15.4 mm-40 -59.54 168.28 1.67 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.399 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.54 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 11.42 108.21 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.849 0.718 . . . . 0.0 111.883 -179.567 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -177.97 143.48 0.48 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.698 -179.789 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.414 ' C ' ' O ' ' A' ' 11' ' ' TYR . 33.0 Cg_exo -28.98 83.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.179 2.586 . . . . 0.0 113.316 -179.686 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.571 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -58.26 -39.48 73.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.148 179.468 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.23 -39.25 94.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.208 -179.763 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 91.29 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.914 0.388 . . . . 0.0 110.868 -179.908 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -172.86 111.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.392 -179.689 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -149.13 -22.4 0.3 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.504 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.486 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -166.22 176.73 7.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.212 0.529 . . . . 0.0 111.518 -179.27 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.475 ' C ' ' OD1' ' A' ' 20' ' ' ASN . . . -58.71 103.45 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.85 -179.999 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.547 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.6 p-10 176.24 -88.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.973 178.982 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.766 HE21 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -27.57 -85.63 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.418 -0.113 . . . . 0.0 111.231 -179.84 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.627 ' N ' HE21 ' A' ' 21' ' ' GLN . 0.8 OUTLIER -52.33 -56.58 13.9 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.6 0.238 . . . . 0.0 111.269 -179.77 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.548 HD22 ' N ' ' A' ' 35' ' ' GLY . 3.9 t-20 -49.05 -74.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.102 0.477 . . . . 0.0 110.49 179.968 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.547 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -49.84 -42.49 47.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.399 179.685 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 29' ' ' ASP . 69.1 m-20 -55.19 -66.47 0.4 Allowed 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.649 -179.688 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 1.8 m -52.69 -39.68 62.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.26 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tptm -57.16 2.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.151 179.849 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.499 ' H ' ' C ' ' A' ' 26' ' ' CYS . 64.0 tp -163.78 -37.56 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -66.81 -51.62 53.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.891 0.377 . . . . 0.0 110.505 179.926 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.519 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -106.12 6.48 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.306 179.8 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.519 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 47.12 49.28 15.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.703 -179.859 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.523 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.55 -127.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.444 179.37 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.25 -42.89 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.993 0.425 . . . . 0.0 110.623 179.924 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -158.43 -163.51 1.29 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.32 179.964 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.548 ' N ' HD22 ' A' ' 23' ' ' ASN . . . 167.14 174.69 36.53 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.525 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -175.57 168.73 3.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.778 0.323 . . . . 0.0 110.561 -179.951 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.5 m -88.06 147.49 24.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.277 -179.469 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -146.93 131.41 17.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.606 179.812 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.617 ' CD1' ' O ' ' A' ' 44' ' ' ASN . 21.1 m-85 -74.14 -172.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.399 -179.444 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.502 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 0.8 OUTLIER -163.47 -171.48 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.882 -179.932 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.13 -20.0 63.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.261 -179.638 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 43' ' ' ARG . 19.7 mmtt -99.43 29.11 4.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.046 179.871 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LYS . 11.9 ttt180 35.76 34.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.83 -179.957 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.617 ' O ' ' CD1' ' A' ' 39' ' ' TYR . 2.5 m-20 -94.6 -162.84 0.98 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 -179.949 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.0 mt -146.22 100.06 3.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 110.991 -179.58 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -92.96 149.69 21.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 179.842 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.51 110.31 22.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.116 -179.552 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.407 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 9.6 mm -87.95 128.26 40.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 179.984 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 61.1 m -108.39 116.65 32.36 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 179.513 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.523 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -94.82 133.39 38.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.915 0.388 . . . . 0.0 110.116 179.324 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -100.66 -33.8 10.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.2 -178.751 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.489 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.654 -179.8 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.531 0.228 0 CA-C-O 121.298 0.571 . . . . 0.0 109.981 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -143.97 92.96 2.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.71 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -96.3 127.46 42.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.691 0.281 . . . . 0.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.2 m -66.03 133.65 30.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 112.091 -179.787 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.483 ' O ' ' O ' ' A' ' 9' ' ' GLU . 13.5 t80 -77.09 93.84 3.94 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.688 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' O ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -47.96 -179.21 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.303 -177.922 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.579 ' O ' ' O ' ' A' ' 9' ' ' GLU . 43.5 m-20 16.34 109.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.675 0.609 . . . . 0.0 111.987 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.674 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 12.8 t80 -173.07 144.52 1.18 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.144 -179.071 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.93 ' O ' HG23 ' A' ' 13' ' ' VAL . 81.2 Cg_exo -43.56 -134.86 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 123.108 2.539 . . . . 0.0 113.831 -179.378 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 12' ' ' PRO . 2.2 t -177.46 -56.52 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.879 -179.031 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.8 p -60.08 66.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.865 -178.729 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.697 ' O ' ' N ' ' A' ' 17' ' ' GLN . 4.5 mttm -174.47 -68.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.29 179.201 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.721 ' O ' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER 13.04 -66.5 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 178.94 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.697 ' N ' ' O ' ' A' ' 15' ' ' LYS . 23.4 mt-30 -54.65 51.52 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.638 0.586 . . . . 0.0 111.842 -178.744 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.721 ' N ' ' O ' ' A' ' 16' ' ' CYS . 11.7 mt -165.45 98.79 0.7 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.606 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.51 86.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.849 -179.424 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.612 ' O ' ' N ' ' A' ' 22' ' ' CYS . 3.7 t-20 -173.51 -78.12 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.816 -179.757 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.607 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER -60.46 41.4 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.521 -179.921 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 15.6 m -170.23 -59.01 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.147 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 27' ' ' LYS . 1.0 OUTLIER -56.69 -54.54 45.03 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.576 178.112 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.544 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.92 -47.91 76.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.028 178.957 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.628 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.0 m-20 -58.09 -68.75 0.22 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.409 -179.983 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.504 ' C ' ' H ' ' A' ' 28' ' ' LEU . 56.2 m -51.87 -41.46 61.89 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.023 -179.94 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.455 ' CG ' ' O ' ' A' ' 27' ' ' LYS . 17.0 tttp -59.83 6.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.08 179.776 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.2 tp -164.68 -41.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.532 -0.467 . . . . 0.0 112.121 -179.396 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.628 ' N ' ' O ' ' A' ' 25' ' ' ASP . 55.4 m-20 -69.27 -12.98 62.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.29 -179.746 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.548 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 1.1 mptm? -138.19 6.05 2.56 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.831 0.348 . . . . 0.0 110.639 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.548 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 52.38 35.52 17.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.231 0.539 . . . . 0.0 110.447 -179.818 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.53 -167.22 1.76 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.649 179.702 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.01 -31.04 13.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.11 0.481 . . . . 0.0 109.856 179.63 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -171.93 -175.16 1.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.836 179.719 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.429 ' N ' ' HA ' ' A' ' 23' ' ' ASN . . . -152.11 95.23 0.15 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 119.965 -1.112 . . . . 0.0 113.519 -179.733 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.598 ' CG ' ' H ' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -74.76 -159.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.369 0.604 . . . . 0.0 111.894 179.775 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -153.25 137.69 16.73 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.305 179.559 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -150.71 158.91 44.71 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -178.538 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.764 ' CG ' ' N ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -169.75 -153.71 0.11 Allowed 'General case' 0 C--N 1.343 0.318 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.228 179.548 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.764 ' N ' ' CG ' ' A' ' 39' ' ' TYR . 0.2 OUTLIER 175.12 95.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.63 0.252 . . . . 0.0 111.131 179.333 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.411 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 8.5 mt-10 87.11 -70.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.704 179.565 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.642 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -150.38 29.23 0.71 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -179.665 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.643 ' C ' ' H ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -65.11 16.19 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.954 -179.328 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.642 ' H ' ' C ' ' A' ' 42' ' ' LYS . 30.4 m120 63.15 -15.82 0.06 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.261 -179.919 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.656 HD12 ' N ' ' A' ' 46' ' ' GLN . 4.3 tp 59.5 133.43 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.904 177.873 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.656 ' N ' HD12 ' A' ' 45' ' ' LEU . 1.8 mp0 -141.34 165.05 28.59 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.555 0.693 . . . . 0.0 112.571 -178.514 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.674 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 63.0 m -80.65 110.15 15.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.037 -179.965 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.423 ' O ' ' N ' ' A' ' 36' ' ' GLU . 1.4 mp -93.6 126.23 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.888 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 98.5 m -88.98 117.23 27.84 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.439 179.688 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -93.48 121.13 34.57 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.386 179.481 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -100.38 -17.36 17.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.931 -179.121 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.7 m . . . . . 0 C--N 1.33 -0.265 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.142 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.162 0 CA-C-O 120.704 0.288 . . . . 0.0 111.481 . . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -90.86 133.63 35.08 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.196 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.79 122.56 10.57 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.087 178.786 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.0 m -60.87 145.33 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 0.0 111.561 -179.695 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.523 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -87.64 60.35 5.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.001 179.418 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.552 ' C ' ' H ' ' A' ' 11' ' ' TYR . 35.5 mt-10 30.57 -158.61 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.021 179.707 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.422 ' OD1' ' O ' ' A' ' 10' ' ' ASN . 14.7 p30 -58.48 34.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.649 -179.149 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.677 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 5.5 t80 -50.92 135.16 28.22 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.486 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.447 ' C ' ' O ' ' A' ' 11' ' ' TYR . 39.9 Cg_exo -30.95 84.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.329 2.02 . . . . 0.0 112.318 179.512 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.605 ' N ' ' O ' ' A' ' 11' ' ' TYR . 42.9 t -55.77 -15.64 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.956 -179.536 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.4 p -62.16 -93.71 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.8 -179.196 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -67.82 153.25 44.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.331 0.586 . . . . 0.0 112.35 -178.793 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -174.52 -67.99 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.471 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.413 ' O ' ' C ' ' A' ' 18' ' ' LEU . 6.0 mm100 56.37 28.17 13.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.016 0.436 . . . . 0.0 111.065 179.59 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.659 HD23 ' H ' ' A' ' 37' ' ' CYS . 40.4 mt 35.59 75.9 0.05 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.22 179.542 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -178.56 -147.94 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.343 179.719 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.548 ' O ' ' C ' ' A' ' 21' ' ' GLN . 3.0 t-20 -21.14 -107.96 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.453 -179.377 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.548 ' C ' ' O ' ' A' ' 20' ' ' ASN . 4.6 mm100 -5.81 -73.88 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.245 -179.575 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.6 t -57.5 -68.61 0.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.478 179.923 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -48.38 -59.5 3.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 -179.69 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.422 179.583 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.636 ' O ' ' N ' ' A' ' 29' ' ' ASP . 22.4 m-20 -50.93 -60.53 2.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.29 179.751 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.2 m -53.1 -53.98 42.3 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.714 179.278 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 14.27 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.672 -179.832 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.735 ' C ' HD13 ' A' ' 28' ' ' LEU . 2.8 tm? -165.02 -52.19 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 119.876 -0.729 . . . . 0.0 112.613 -179.483 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.636 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -66.05 -15.72 63.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.574 0.226 . . . . 0.0 111.094 -179.06 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -134.31 13.16 3.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.733 0.301 . . . . 0.0 110.834 -179.973 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.4 m80 46.29 36.46 3.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.947 -179.955 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.4 -172.93 4.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.76 179.892 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -95.96 -45.31 6.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.889 179.959 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.3 p -177.55 154.74 1.01 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.534 179.833 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.63 -164.87 16.34 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.125 -1.036 . . . . 0.0 113.254 -179.684 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -177.19 175.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.699 0.285 . . . . 0.0 110.448 -179.864 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.659 ' H ' HD23 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -88.19 149.49 23.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.135 0.493 . . . . 0.0 111.918 -179.834 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' A' ' 37' ' ' CYS . 26.5 m-85 -148.91 145.68 27.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.168 179.388 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.501 ' O ' ' O ' ' A' ' 44' ' ' ASN . 17.0 m-85 -73.79 -102.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -179.522 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.463 ' CG ' ' O ' ' A' ' 39' ' ' TYR . 0.6 OUTLIER 48.97 -167.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.264 0.554 . . . . 0.0 111.086 -179.788 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER 27.64 63.17 0.1 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.307 -178.85 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.513 ' O ' ' N ' ' A' ' 44' ' ' ASN . 5.5 ttpt 69.68 65.95 0.25 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 178.655 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.475 ' HD3' ' H ' ' A' ' 43' ' ' ARG . 8.7 mmt85 32.76 33.51 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.558 178.986 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.513 ' N ' ' O ' ' A' ' 42' ' ' LYS . 10.5 m-20 -95.64 129.93 42.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 178.891 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.08 86.38 7.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.13 0.49 . . . . 0.0 110.988 -179.574 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -89.64 158.46 17.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.658 179.832 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.677 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -99.67 108.94 21.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.641 -179.506 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.2 mt -85.83 110.22 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.076 179.498 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.2 m -97.34 121.96 39.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.538 179.438 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.477 ' OD2' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -98.91 134.86 41.17 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.516 0.674 . . . . 0.0 110.859 179.791 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -121.0 66.41 0.86 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.28 -178.917 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.477 ' SG ' ' OD2' ' A' ' 50' ' ' ASP . 77.8 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.777 0.322 . . . . 0.0 111.457 -179.709 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.136 0 CA-C-O 120.666 0.27 . . . . 0.0 110.283 . . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.654 ' CD ' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -97.87 145.37 26.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.069 0.462 . . . . 0.0 111.039 179.904 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -153.95 110.3 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.763 179.864 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -61.31 137.06 24.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.9 0.381 . . . . 0.0 111.656 -179.869 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.514 ' O ' ' C ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -64.51 66.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.598 179.056 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 7' ' ' VAL . 12.6 mp0 17.21 -115.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.415 178.99 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.672 HD22 ' N ' ' A' ' 10' ' ' ASN . 1.3 m120 -50.34 -72.22 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.784 -179.816 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.663 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 2.4 t80 10.89 79.24 0.06 OUTLIER Pre-proline 0 N--CA 1.466 0.365 0 O-C-N 123.791 0.682 . . . . 0.0 112.147 -178.836 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -46.54 -53.35 6.16 Favored 'Trans proline' 0 CA--C 1.518 -0.304 0 C-N-CA 122.877 2.385 . . . . 0.0 112.524 -179.675 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.49 ' O ' ' C ' ' A' ' 14' ' ' SER . 1.2 t 173.58 -50.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.52 179.615 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.551 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 5.5 p 23.05 55.23 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.875 -179.812 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.551 ' CB ' ' O ' ' A' ' 14' ' ' SER . 28.1 tptt 92.86 141.0 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.489 179.559 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.1 m -174.35 21.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.959 179.795 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.511 ' C ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER -101.03 44.65 1.0 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.342 0.592 . . . . 0.0 110.702 -179.783 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.9 mt -158.84 -129.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.449 179.744 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.43 46.66 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.531 -179.653 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.659 ' ND2' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -141.33 -47.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.611 179.795 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.659 ' N ' ' ND2' ' A' ' 20' ' ' ASN . 5.7 tp60 -47.96 -80.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.835 179.904 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.663 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 22.5 m -62.48 -33.67 75.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.385 -179.902 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -53.46 -65.79 0.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.014 0.435 . . . . 0.0 109.87 179.29 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.569 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.05 -38.58 68.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.071 178.968 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 29' ' ' ASP . 25.2 m-20 -52.45 -63.45 1.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.397 179.622 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.433 ' C ' ' H ' ' A' ' 28' ' ' LEU . 36.8 m -55.27 -39.31 69.68 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.08 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -59.37 3.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.586 -179.6 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' A' ' 26' ' ' CYS . 36.1 tp -165.93 -33.2 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.582 ' N ' ' O ' ' A' ' 25' ' ' ASP . 4.7 m-20 -65.83 -16.7 64.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.893 0.378 . . . . 0.0 110.487 -179.656 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.1 mtpm? -144.57 0.29 0.99 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.032 179.801 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m80 62.39 39.08 12.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.455 179.719 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.894 ' HB2' ' CZ ' ' A' ' 51' ' ' TYR . . . -86.81 -171.02 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.676 179.538 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.475 ' HD2' ' H ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -89.28 -39.0 13.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.768 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.479 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.3 p -175.85 -147.33 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.294 179.666 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.479 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 149.24 173.48 19.9 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.555 -0.831 . . . . 0.0 113.36 179.952 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.45 ' CD ' ' O ' ' A' ' 35' ' ' GLY . 1.3 pm0 -175.11 172.41 2.81 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.683 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 145.64 25.61 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.663 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -145.15 149.34 34.82 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.35 179.551 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.604 ' CZ ' HD11 ' A' ' 45' ' ' LEU . 26.5 m-85 -80.54 150.44 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 111.355 -179.637 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 43' ' ' ARG . 24.8 p30 -99.12 -178.17 3.85 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.144 -179.863 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -63.01 -12.15 24.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.509 -179.477 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -94.92 -77.28 0.47 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.233 179.526 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.402 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 3.1 ptp180 175.45 1.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.329 -0.851 . . . . 0.0 112.161 179.482 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.502 HD22 ' N ' ' A' ' 44' ' ' ASN . 1.4 m-80 -93.97 151.64 19.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 111.316 -179.366 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.675 ' N ' HD12 ' A' ' 45' ' ' LEU . 2.9 mp -91.02 153.9 19.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.201 -179.707 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -144.52 132.7 21.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.278 179.689 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 83.8 m -81.35 105.58 12.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 112.073 -179.005 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.1 mt -88.47 120.73 37.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.188 179.43 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.2 m -92.67 119.38 32.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.402 178.889 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.747 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 20.5 t0 -86.63 144.93 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.514 -179.303 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.894 ' CZ ' ' HB2' ' A' ' 32' ' ' ALA . 83.6 m-85 -138.84 42.15 2.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.36 -178.793 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.475 ' H ' ' HD2' ' A' ' 33' ' ' ARG . 71.0 m . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.666 -178.869 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.463 0.215 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -142.58 103.61 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.65 0.262 . . . . 0.0 110.465 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -142.05 131.67 24.01 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.219 0.533 . . . . 0.0 111.635 -179.502 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.781 HG23 ' H ' ' A' ' 9' ' ' GLU . 2.4 m -66.57 153.19 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.107 178.745 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.585 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.4 OUTLIER -81.81 36.3 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.086 0.47 . . . . 0.0 110.154 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.781 ' H ' HG23 ' A' ' 7' ' ' VAL . 2.3 pt-20 10.86 -100.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.946 179.066 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 11' ' ' TYR . 2.7 m120 -43.22 -72.45 0.06 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.501 -178.767 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.529 ' C ' ' O ' ' A' ' 10' ' ' ASN . 33.5 t80 16.57 102.12 0.02 OUTLIER Pre-proline 0 N--CA 1.469 0.508 0 O-C-N 123.471 0.482 . . . . 0.0 111.819 -178.93 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -42.6 93.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.319 2.012 . . . . 0.0 112.936 -179.568 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.9 t -56.2 96.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.9 p -178.57 23.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.119 179.633 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -174.45 107.71 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.378 -179.987 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -170.25 -10.58 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.156 -179.373 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -62.57 19.69 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.757 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.623 ' H ' ' C ' ' A' ' 16' ' ' CYS . 14.0 mt -164.73 134.32 3.73 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.741 0.305 . . . . 0.0 110.324 179.954 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.428 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.16 -176.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 0.0 111.265 179.652 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.4 OUTLIER 81.9 -78.34 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.753 -179.828 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.49 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -29.15 -83.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.079 179.982 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.39 -46.07 91.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.061 0.458 . . . . 0.0 110.926 179.548 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.441 ' HA ' ' H ' ' A' ' 35' ' ' GLY . 0.1 OUTLIER -52.82 -75.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.22 -179.634 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.516 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -47.43 -47.19 26.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.869 -179.947 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.583 ' O ' ' N ' ' A' ' 29' ' ' ASP . 88.7 m-20 -52.12 -73.64 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.575 -179.248 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -51.59 -38.29 53.82 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.913 -179.833 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.405 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 64.9 tttt -63.15 7.18 0.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.964 179.392 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.478 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.8 tt -161.96 -22.29 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.859 -179.529 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -69.32 -55.59 10.01 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.025 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -101.17 3.44 41.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.134 179.312 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.9 m80 70.66 45.29 0.59 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.665 -179.547 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.49 -143.95 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.32 -179.717 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 50' ' ' ASP . 0.6 OUTLIER -142.54 -31.68 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.136 179.977 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 p -157.52 117.69 3.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.819 0.343 . . . . 0.0 111.876 -179.635 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.441 ' H ' ' HA ' ' A' ' 23' ' ' ASN . . . -104.6 71.86 0.25 Allowed Glycine 0 C--N 1.337 0.584 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.596 179.731 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -73.25 179.5 3.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.116 0.484 . . . . 0.0 111.816 -179.998 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -148.17 142.51 26.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.941 179.587 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -148.7 143.41 26.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -178.769 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.479 ' CD1' ' C ' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -169.71 159.01 7.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.195 -1.366 . . . . 0.0 109.841 179.034 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -96.62 -82.51 0.4 Allowed 'General case' 0 CA--C 1.502 -0.87 0 CA-C-O 121.214 0.53 . . . . 0.0 111.91 -178.966 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.487 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -165.48 8.26 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.515 -179.657 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.414 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -98.12 2.93 49.1 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.768 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.414 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER 80.69 21.13 0.45 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.201 179.917 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -94.14 74.46 4.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-O 121.604 0.716 . . . . 0.0 109.845 179.001 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.2 tp -97.81 139.1 34.18 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.517 -1.22 . . . . 0.0 112.6 -178.09 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -141.85 144.89 34.1 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.022 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -97.38 110.1 22.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.808 -179.835 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -87.71 112.21 23.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 179.774 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.2 m -105.85 104.37 14.07 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.291 179.929 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 33' ' ' ARG . 4.3 t70 -96.16 136.18 36.97 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.008 179.275 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -101.84 -24.45 14.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.7 -178.548 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.136 179.803 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.941 0.401 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -97.07 146.16 25.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.487 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 mtpm? -150.33 121.34 7.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.994 0.426 . . . . 0.0 111.376 -179.942 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.428 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.0 OUTLIER -66.04 151.3 10.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.902 179.407 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.555 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.6 OUTLIER -83.88 81.88 8.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.687 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 17.0 pt-20 -61.61 72.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.616 -179.495 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.579 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 31.4 t30 127.04 101.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.511 1.132 . . . . 0.0 110.527 -179.871 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -179.3 134.15 0.28 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.61 ' O ' ' N ' ' A' ' 14' ' ' SER . 89.0 Cg_endo -79.58 122.54 5.05 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.171 1.914 . . . . 0.0 112.553 -179.972 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.6 t -61.16 43.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.243 179.606 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.61 ' N ' ' O ' ' A' ' 12' ' ' PRO . 10.1 p -62.6 -110.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.952 0.406 . . . . 0.0 111.434 -179.502 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -67.59 23.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.41 -179.633 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -66.04 -26.06 67.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.751 179.736 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -67.38 12.67 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.973 -179.806 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.53 ' H ' ' C ' ' A' ' 16' ' ' CYS . 16.8 mt -162.89 124.34 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.426 -179.862 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.04 107.37 0.35 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.48 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -174.56 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.267 179.998 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -46.13 -64.66 0.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.355 -179.652 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 t -56.11 -53.52 56.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.274 -179.545 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -51.68 -72.59 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.931 -179.845 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.81 -44.57 28.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.437 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 7.2 m-20 -55.51 -74.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.498 -179.542 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.508 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 0.5 OUTLIER -52.17 -34.09 43.49 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.164 -179.658 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.21 1.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.263 179.34 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.493 ' H ' ' C ' ' A' ' 26' ' ' CYS . 57.9 tp -162.92 -29.82 0.04 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.991 -179.728 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.06 -48.58 57.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.765 0.317 . . . . 0.0 110.692 179.846 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -100.2 18.03 19.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.938 -179.918 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.1 m170 55.43 44.74 26.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 -179.727 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -87.4 -160.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.493 -179.732 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.507 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 40.4 ttm-85 -139.01 -27.3 0.82 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 -179.856 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 1.5 p -178.64 120.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.126 179.712 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -118.91 179.37 16.79 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.363 -179.271 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -178.71 145.71 0.31 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.65 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.93 131.37 34.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.833 0.349 . . . . 0.0 111.181 -179.675 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.438 ' O ' HD12 ' A' ' 45' ' ' LEU . 51.3 m-85 -146.7 171.35 15.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.303 -179.653 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -86.13 134.53 33.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.225 179.318 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 42' ' ' LYS . 2.4 p-10 -142.07 -83.23 0.19 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.19 0.519 . . . . 0.0 112.165 -179.101 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.576 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.1 OUTLIER -59.72 70.47 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.221 -178.095 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.4 mptt 53.81 85.07 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.536 179.252 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.652 ' H ' ' HE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER 57.92 18.49 5.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.756 179.109 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.576 ' ND2' ' O ' ' A' ' 41' ' ' GLU . 1.9 m-80 -93.8 115.75 28.18 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 179.327 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.438 HD12 ' O ' ' A' ' 38' ' ' PHE . 21.2 tp -82.75 93.07 7.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.407 -179.026 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -100.94 -178.92 3.9 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.39 179.87 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -104.79 104.07 13.79 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.491 -179.568 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.821 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.0 OUTLIER -88.65 109.53 20.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.511 179.305 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.0 m -96.95 119.18 34.94 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.774 0.321 . . . . 0.0 111.267 -179.709 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.503 ' CB ' ' O ' ' A' ' 34' ' ' SER . 2.2 t0 -94.48 137.08 34.05 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.185 0.517 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.507 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 5.6 m-85 -103.61 -17.89 14.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.46 179.996 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.0 m . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.972 -179.59 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.126 0 CA-C-O 120.855 0.36 . . . . 0.0 110.558 . . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.41 ' O ' ' CE ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -147.08 145.55 29.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.998 179.972 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HZ1' ' CD ' ' A' ' 9' ' ' GLU . 8.3 tttp -146.73 116.86 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.128 0.49 . . . . 0.0 110.861 -179.777 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -63.25 142.75 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.456 -179.573 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.563 ' C ' ' H ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -62.78 110.95 1.91 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.833 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.455 ' C ' ' OD1' ' A' ' 10' ' ' ASN . 26.7 mt-10 -60.65 5.86 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.398 -178.674 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.563 ' H ' ' C ' ' A' ' 8' ' ' TYR . 1.8 p-10 172.2 122.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.8 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.627 ' O ' ' N ' ' A' ' 13' ' ' VAL . 19.8 t80 -179.72 123.54 0.23 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.089 179.955 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.14 76.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.397 2.065 . . . . 0.0 113.138 -179.634 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.627 ' N ' ' O ' ' A' ' 11' ' ' TYR . 1.4 p -58.68 97.15 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.144 0.497 . . . . 0.0 110.981 179.849 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.533 ' C ' ' H ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -178.0 -57.78 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.778 -179.867 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.553 ' C ' ' H ' ' A' ' 17' ' ' GLN . 13.7 tttp -67.21 10.25 0.17 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.666 179.987 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.533 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -67.61 19.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.233 -179.921 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.688 ' C ' HD12 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -88.33 56.32 3.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 110.875 -179.682 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.688 HD12 ' C ' ' A' ' 17' ' ' GLN . 5.5 mp -161.92 -122.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.671 179.737 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 174.01 28.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 -179.688 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 21' ' ' GLN . 29.1 t-20 -131.19 -52.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.486 179.961 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.42 ' C ' ' O ' ' A' ' 20' ' ' ASN . 8.2 mm-40 -37.19 -86.87 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.916 -179.764 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.8 m -59.87 -37.33 79.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.536 0.208 . . . . 0.0 111.326 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.485 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 13.5 t-20 -56.28 -75.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.68 0.276 . . . . 0.0 110.954 179.788 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.512 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -48.86 -43.57 38.93 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.906 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.509 ' O ' ' N ' ' A' ' 29' ' ' ASP . 10.7 m-20 -51.89 -57.36 9.61 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.684 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.3 m -53.62 -44.55 69.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.406 0.622 . . . . 0.0 109.464 178.801 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -62.51 7.51 0.07 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 113.165 -178.78 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.87 -37.65 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.933 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.509 ' N ' ' O ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -66.79 -12.55 59.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.769 0.319 . . . . 0.0 111.081 -179.259 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -144.63 10.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.082 179.768 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.7 m80 54.9 46.8 23.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.555 -179.883 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.6 -174.19 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.382 -179.664 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.401 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 0.9 OUTLIER -96.66 -59.63 1.77 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.229 179.586 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.449 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 3.9 p -158.05 114.05 2.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.694 179.991 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.485 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -105.62 164.26 13.99 Favored Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.142 -179.618 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -176.43 167.66 2.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.982 0.42 . . . . 0.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.4 m -89.29 130.01 35.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.278 -179.716 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -148.22 161.98 40.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.955 179.898 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.58 ' O ' ' N ' ' A' ' 41' ' ' GLU . 75.4 m-85 -91.2 115.28 27.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.816 179.799 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.492 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 6.8 p-10 -57.11 77.12 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.51 0.671 . . . . 0.0 110.492 179.854 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 39' ' ' TYR . 34.4 mt-10 27.87 40.57 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.688 -1.142 . . . . 0.0 112.177 -179.724 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -142.23 -81.83 0.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.099 178.807 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 10.1 mtp180 160.74 23.73 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.97 179.789 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.474 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 98.9 m-20 -97.65 -13.61 21.42 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.591 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.514 HD13 ' CZ ' ' A' ' 39' ' ' TYR . 5.9 tp 57.68 122.19 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.644 0.259 . . . . 0.0 111.15 -179.665 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.474 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -149.54 -179.14 6.86 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.423 179.107 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.524 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 36.3 m -102.07 139.14 38.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 14.5 mt -139.4 121.21 16.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 0.0 112.052 -178.884 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 m -92.63 124.11 36.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.018 178.468 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' A' ' 34' ' ' SER . 9.0 t70 -88.49 124.38 33.93 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.126 0.489 . . . . 0.0 111.192 -179.319 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -115.18 50.2 1.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.311 -179.383 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 69.4 m . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.542 179.916 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.815 0.34 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 135.5 26.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.436 179.924 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -149.79 121.87 8.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.913 0.387 . . . . 0.0 111.285 179.829 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -61.85 161.98 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.179 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.233 179.782 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.424 ' CD1' ' HB2' ' A' ' 11' ' ' TYR . 0.2 OUTLIER -113.15 84.49 2.01 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.473 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -57.94 -79.62 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.146 -178.174 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.604 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 6.9 t-20 -38.96 -38.88 0.48 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.696 -178.416 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' HB2' ' CD1' ' A' ' 8' ' ' TYR . 53.0 t80 -52.87 124.84 37.56 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.585 -178.939 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.562 ' C ' ' H ' ' A' ' 14' ' ' SER . 73.0 Cg_exo -46.35 112.32 0.45 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 122.148 1.898 . . . . 0.0 112.579 179.567 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.3 p -60.59 7.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.477 179.598 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.562 ' H ' ' C ' ' A' ' 12' ' ' PRO . 5.1 p -60.66 -108.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.558 -179.252 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 ttpm? -63.44 149.74 45.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 -179.527 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -171.94 3.92 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.608 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.537 HE21 ' CA ' ' A' ' 17' ' ' GLN . 0.1 OUTLIER -86.62 -32.24 20.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.978 -179.892 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.576 ' C ' ' H ' ' A' ' 20' ' ' ASN . 1.3 mm? -68.86 116.26 9.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.726 -179.415 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.19 39.06 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.076 179.161 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.576 ' H ' ' C ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -136.71 -108.04 0.2 Allowed 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.941 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.555 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER 0.9 -80.59 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.069 0.547 . . . . 0.0 112.439 179.182 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.0 t -58.01 -58.07 10.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.889 179.848 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -52.83 -56.96 11.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.459 179.957 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -53.14 -52.52 58.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.352 179.46 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.8 m-20 -50.99 -50.16 58.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.29 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.496 ' C ' ' H ' ' A' ' 28' ' ' LEU . 1.2 m -51.83 -54.26 30.96 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.447 0.641 . . . . 0.0 109.331 178.696 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -61.25 14.75 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.683 -179.806 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.54 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -167.2 -53.63 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.378 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -65.81 -13.26 59.15 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.569 0.223 . . . . 0.0 111.483 -178.884 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 31' ' ' HIS . 3.0 mmmp? -139.79 24.02 2.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.009 0.433 . . . . 0.0 110.776 179.875 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.441 ' C ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 34.0 38.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.089 179.636 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.76 179.99 6.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.909 0.385 . . . . 0.0 110.937 179.923 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 mmm-85 -92.27 -27.19 17.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.266 0.555 . . . . 0.0 109.837 179.724 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.6 p 178.37 -168.09 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.836 179.629 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.41 -177.16 47.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.352 179.975 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.45 -154.42 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -179.836 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.94 142.86 30.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.733 0.301 . . . . 0.0 110.574 179.493 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.492 ' O ' HD12 ' A' ' 45' ' ' LEU . 66.5 m-85 -146.88 164.41 32.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.124 0.487 . . . . 0.0 111.585 -179.41 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.405 ' CE2' HD13 ' A' ' 45' ' ' LEU . 22.2 m-85 -101.59 119.3 38.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.078 -179.8 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.591 ' C ' ' H ' ' A' ' 42' ' ' LYS . 11.4 p-10 -51.75 168.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.623 179.703 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -64.22 36.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.495 -179.835 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 40' ' ' ASP . 3.6 mmtp -146.86 -81.25 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.171 179.625 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -176.82 20.7 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.112 179.677 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.78 124.66 46.75 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.65 179.527 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 38' ' ' PHE . 51.6 tp -89.51 138.48 31.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.389 179.424 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -147.61 145.8 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 111.63 -179.459 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -82.67 109.02 16.48 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.929 -179.96 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.9 mt -90.3 116.88 32.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.912 0.387 . . . . 0.0 111.86 -179.925 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.47 120.1 36.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.685 179.412 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.28 136.28 34.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.958 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -111.16 -6.34 14.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.598 -179.29 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.7 m . . . . . 0 C--O 1.232 0.178 0 CA-C-O 121.035 0.445 . . . . 0.0 111.822 -179.294 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.65 0 CA-C-O 120.85 0.357 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -79.82 5.54 13.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.113 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.489 ' HZ3' ' HB2' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -153.84 151.7 29.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.624 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.51 21.7 0.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.692 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.67 122.48 13.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.752 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -99.93 125.48 45.94 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.436 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.573 ' O ' ' N ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -67.07 127.86 29.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.32 179.571 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.535 ' O ' ' C ' ' A' ' 9' ' ' GLU . 2.9 t80 -61.25 73.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 7' ' ' VAL . 15.0 mp0 16.36 -125.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.67 0.606 . . . . 0.0 111.139 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 57.8 t-20 -57.21 -122.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 6.5 t80 97.64 95.67 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.609 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.24 115.47 1.75 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 121.786 1.658 . . . . 0.0 111.486 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.597 ' O ' ' N ' ' A' ' 15' ' ' LYS . 68.0 t -50.69 -50.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.884 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 69.6 p 19.12 -79.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.502 179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' A' ' 13' ' ' VAL . 21.3 tptp -65.44 -87.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.155 -178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.468 ' C ' ' O ' ' A' ' 15' ' ' LYS . 2.2 m 28.1 81.3 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 121.021 0.438 . . . . 0.0 111.625 -179.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -142.26 -23.73 0.67 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.689 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.425 ' O ' ' O ' ' A' ' 19' ' ' ALA . 1.4 mt -165.17 -176.41 4.08 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.366 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.425 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -54.73 -157.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.118 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 21' ' ' GLN . 30.9 t30 76.38 -87.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.51 -1.223 . . . . 0.0 112.104 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.448 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -30.29 -90.37 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -178.729 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.6 m -55.68 -45.42 77.79 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -178.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -51.83 -71.74 0.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.428 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -49.91 -59.52 3.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.359 -179.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.9 m-20 -49.17 -54.75 14.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.371 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.505 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.0 m -54.74 -41.98 71.05 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.198 -0.601 . . . . 0.0 109.823 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -62.14 10.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.012 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.672 ' O ' HD23 ' A' ' 28' ' ' LEU . 6.0 tt -165.49 -45.52 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.615 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 9.9 m-20 -67.16 -15.26 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.082 -179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.453 ' O ' ' C ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -141.37 30.07 1.76 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.0 0.428 . . . . 0.0 110.808 179.586 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.453 ' C ' ' O ' ' A' ' 30' ' ' LYS . 4.5 m80 32.42 39.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.242 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 30' ' ' LYS . . . -87.69 -176.64 5.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.827 0.346 . . . . 0.0 111.037 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.96 -38.28 11.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.328 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.519 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.9 OUTLIER -163.61 -157.08 0.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.401 179.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.519 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 163.07 169.21 26.17 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.143 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -178.05 170.2 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.626 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 55.4 m -86.7 127.39 34.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.767 0.318 . . . . 0.0 110.484 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.41 ' HB2' HD13 ' A' ' 48' ' ' ILE . 39.2 m-85 -142.12 165.98 25.95 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.373 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.475 ' HB2' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -145.1 -178.1 5.88 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.856 179.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.5 OUTLIER -121.79 -178.29 3.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.072 -179.906 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.32 42.97 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.399 -179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.539 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER -138.44 -25.29 0.93 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.932 179.835 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.539 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 2.2 tpt180 89.63 61.36 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.27 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.482 ' OD1' ' O ' ' A' ' 43' ' ' ARG . 4.9 m-20 -142.87 105.73 4.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.583 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.484 ' O ' HG22 ' A' ' 13' ' ' VAL . 35.8 mt -86.57 136.2 33.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.543 0.687 . . . . 0.0 112.566 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.494 ' O ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -145.67 153.87 41.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.22 179.4 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.535 ' SG ' ' CZ ' ' A' ' 11' ' ' TYR . 1.8 m -75.89 101.37 5.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.368 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 46' ' ' GLN . 2.1 mp -89.27 121.7 39.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.796 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 80.3 m -95.64 117.3 30.21 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -90.52 133.86 34.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.0 0.429 . . . . 0.0 111.542 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -103.63 -25.71 13.07 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.18 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.89 86.67 1.8 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.952 0.406 . . . . 0.0 111.159 -179.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -167.71 59.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.056 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.025 179.8 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.584 0 CA-C-O 120.868 0.366 . . . . 0.0 111.342 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.452 ' CG ' ' N ' ' A' ' 3' ' ' LYS . 5.7 p-10 -61.98 -55.08 33.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.202 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.452 ' N ' ' CG ' ' A' ' 2' ' ' ASP . 3.3 ttpp 51.64 94.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.974 0.416 . . . . 0.0 110.884 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 175.2 18.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.367 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -95.81 139.46 32.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.998 0.427 . . . . 0.0 111.275 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -140.39 101.83 4.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.818 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.442 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -61.8 130.39 25.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.814 -178.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.477 ' O ' ' C ' ' A' ' 9' ' ' GLU . 1.1 t80 -72.66 67.33 0.77 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.477 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.0 mt-10 32.11 -149.7 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.302 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.587 ' CG ' ' H ' ' A' ' 11' ' ' TYR . 9.3 p30 -50.9 -67.33 0.26 Allowed 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.401 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.587 ' H ' ' CG ' ' A' ' 10' ' ' ASN . 23.4 t80 99.4 128.72 0.02 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 C-N-CA 123.306 0.643 . . . . 0.0 110.585 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.714 ' O ' HG23 ' A' ' 13' ' ' VAL . 72.6 Cg_exo -44.92 -69.16 0.09 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 121.353 1.369 . . . . 0.0 111.759 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.779 ' O ' HG12 ' A' ' 13' ' ' VAL . 66.2 t 110.44 18.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.801 1.313 . . . . 0.0 110.148 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.29 -21.52 65.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.639 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.94 141.04 0.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.923 0.392 . . . . 0.0 111.098 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -176.65 58.67 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.467 0.651 . . . . 0.0 110.389 179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.496 ' C ' HD12 ' A' ' 18' ' ' LEU . 95.1 mm-40 -106.58 -22.72 12.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.704 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.496 HD12 ' C ' ' A' ' 17' ' ' GLN . 3.6 mp -163.38 170.47 17.46 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.466 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.98 113.02 1.51 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.668 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -178.77 -95.9 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.172 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -46.11 -53.63 9.99 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.888 0.375 . . . . 0.0 110.319 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.1 t -60.55 -55.91 27.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.741 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -52.95 -65.98 0.46 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.468 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.531 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.29 -47.28 36.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.616 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.5 m-20 -53.55 -62.21 1.8 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.76 0.314 . . . . 0.0 110.531 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.48 ' C ' ' H ' ' A' ' 28' ' ' LEU . 99.3 m -54.4 -41.02 68.8 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.135 0.493 . . . . 0.0 109.968 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 5.24 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.917 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.48 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.4 tp -163.22 -47.12 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.375 -0.53 . . . . 0.0 112.256 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.616 ' N ' ' O ' ' A' ' 25' ' ' ASP . 72.9 m-20 -66.01 -10.95 44.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.241 0.543 . . . . 0.0 109.655 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 31' ' ' HIS . 4.2 tptt -143.33 9.79 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.067 179.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.43 ' C ' ' O ' ' A' ' 30' ' ' LYS . 3.3 p80 35.2 43.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.83 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.43 -166.21 1.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.835 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -33.95 11.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.626 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -174.06 -154.29 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.701 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.46 ' C ' ' OE1' ' A' ' 36' ' ' GLU . . . 152.73 179.65 28.45 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.207 -0.997 . . . . 0.0 113.532 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.46 ' OE1' ' C ' ' A' ' 35' ' ' GLY . 6.7 pm0 -177.53 175.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.671 -0.265 . . . . 0.0 110.307 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.09 148.94 22.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 0.0 111.4 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -146.61 146.02 30.28 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.434 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.483 ' CE1' HD22 ' A' ' 45' ' ' LEU . 11.2 m-85 -76.87 151.44 35.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.103 0.478 . . . . 0.0 111.867 -179.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -101.33 -179.89 4.16 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.759 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -64.7 -7.84 12.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.077 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.32 -80.4 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.08 32.68 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.75 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -128.87 144.53 51.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.82 0.343 . . . . 0.0 111.044 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.483 HD22 ' CE1' ' A' ' 39' ' ' TYR . 0.1 OUTLIER -90.74 148.06 22.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.126 0.489 . . . . 0.0 111.162 -179.802 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -141.78 147.51 37.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.061 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.691 ' C ' HD12 ' A' ' 48' ' ' ILE . 0.8 OUTLIER -70.9 143.21 51.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 112.127 -179.214 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.691 HD12 ' C ' ' A' ' 47' ' ' CYS . 2.0 mp -136.1 115.23 16.12 Favored 'Isoleucine or valine' 0 C--O 1.231 0.117 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.128 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.3 m -91.85 124.71 36.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.493 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -92.98 127.69 38.58 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.878 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -104.52 -3.33 24.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.135 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.1 m -114.91 -105.4 0.4 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.973 0.416 . . . . 0.0 111.06 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.591 ' CD ' ' H ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -165.67 -146.75 0.09 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.581 -179.736 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.591 ' H ' ' CD ' ' A' ' 53' ' ' GLU . 43.4 m-85 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.939 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . 0.506 ' O ' ' OD1' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.445 -0.693 0 CA-C-O 121.124 0.488 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.525 ' CG ' ' N ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER 83.0 -160.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.028 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.525 ' N ' ' CG ' ' A' ' 2' ' ' ASP . 1.2 mmtm 55.4 151.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.165 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -160.42 -25.42 0.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.331 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.416 ' HB3' ' HZ2' ' A' ' 5' ' ' LYS . 0.6 OUTLIER -90.23 136.49 33.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.428 -178.829 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -149.9 123.53 9.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.986 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.64 145.1 12.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.351 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.562 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.2 t80 -92.29 74.5 5.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.818 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.562 ' O ' ' O ' ' A' ' 8' ' ' TYR . 25.8 mt-10 21.12 110.15 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.789 0.681 . . . . 0.0 112.72 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.503 ' C ' ' O ' ' A' ' 9' ' ' GLU . 3.9 t30 15.67 56.94 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.204 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.646 ' CD2' ' SG ' ' A' ' 47' ' ' CYS . 87.4 t80 -54.13 110.15 1.94 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.023 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.606 ' O ' ' N ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.05 117.2 1.77 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.833 1.689 . . . . 0.0 112.148 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.406 ' H ' HG23 ' A' ' 13' ' ' VAL . 2.4 t -60.2 41.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.065 -179.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.606 ' N ' ' O ' ' A' ' 12' ' ' PRO . 25.2 p -63.68 -32.3 73.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 0.0 110.862 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -172.56 141.52 1.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.294 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -173.09 0.07 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -87.49 46.73 1.41 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.532 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 1.8 mt -167.48 -95.85 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.262 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.532 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 170.81 -165.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.827 0.346 . . . . 0.0 110.146 -178.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.584 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.7 t30 60.6 -74.55 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.541 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.515 ' N ' ' O ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -35.62 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 109.969 179.532 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.4 t -62.71 -45.44 92.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.449 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -76.2 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.088 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.584 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -42.3 -41.01 2.64 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.634 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.489 ' O ' ' N ' ' A' ' 29' ' ' ASP . 1.2 m-20 -52.88 -61.51 2.25 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.481 ' C ' ' H ' ' A' ' 28' ' ' LEU . 73.4 m -51.79 -47.33 64.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.001 -0.679 . . . . 0.0 109.501 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -61.18 12.22 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.674 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.8 tt -166.6 -37.88 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.2 OUTLIER -66.62 -14.57 62.59 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.692 -179.378 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -143.2 3.55 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.2 m170 63.51 43.35 5.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.723 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.677 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -88.48 -178.55 5.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.011 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.435 ' HE ' ' C ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -92.82 -35.09 13.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.321 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.7 p -172.37 -159.59 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.928 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 152.17 175.59 23.96 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.83 -1.176 . . . . 0.0 113.524 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG3' ' CE2' ' A' ' 38' ' ' PHE . 3.1 pt-20 -178.59 165.97 1.73 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.502 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.7 OUTLIER -88.16 146.62 25.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.011 0.434 . . . . 0.0 111.514 -179.159 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CE2' ' HG3' ' A' ' 36' ' ' GLU . 33.8 m-85 -144.84 160.03 41.94 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.312 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 40' ' ' ASP . 7.6 m-85 -94.38 86.62 4.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.717 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -42.34 167.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.776 0.322 . . . . 0.0 110.342 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -63.01 -0.32 0.68 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.93 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -110.46 17.63 20.6 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? 60.62 61.45 1.71 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.156 0.503 . . . . 0.0 110.595 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.483 ' O ' ' OD1' ' A' ' 40' ' ' ASP . 87.4 m-20 -147.12 129.74 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.681 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' CD1' ' CZ ' ' A' ' 39' ' ' TYR . 4.7 mt -85.43 100.73 12.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.423 ' OE1' ' OD2' ' A' ' 40' ' ' ASP . 20.3 mt-30 -113.53 145.96 40.39 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.467 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.1 m -82.5 101.49 10.74 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.982 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 mp -88.42 111.77 22.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.82 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 82.7 m -93.85 125.3 38.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.266 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.677 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 65.3 t0 -95.19 140.74 29.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.959 0.409 . . . . 0.0 110.91 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.51 ' CE2' ' HB2' ' A' ' 32' ' ' ALA . 55.8 m-85 -128.91 66.8 1.42 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.323 -178.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.447 ' O ' ' C ' ' A' ' 53' ' ' GLU . 72.7 m -98.98 34.26 2.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.048 0.451 . . . . 0.0 110.875 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.541 ' N ' ' CD ' ' A' ' 53' ' ' GLU . 0.1 OUTLIER -34.87 -48.43 0.39 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.865 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.845 179.924 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.586 0 CA-C-O 120.777 0.322 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.5 p-10 -89.4 -44.31 10.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.706 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.403 ' NZ ' ' OE1' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -135.17 28.33 3.44 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.108 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.503 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.7 m 53.77 41.11 32.15 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.234 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.95 136.48 24.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 111.068 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -151.83 133.19 14.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.142 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.407 HG13 ' H ' ' A' ' 7' ' ' VAL . 1.4 m -65.72 152.56 9.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.367 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.446 ' C ' ' CD1' ' A' ' 8' ' ' TYR . 1.0 OUTLIER -94.47 98.08 10.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.552 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -66.28 116.03 6.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.581 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.409 ' HB2' ' CE1' ' A' ' 8' ' ' TYR . 28.5 t-20 -178.45 -98.58 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.136 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.8 149.79 15.81 Favored Pre-proline 0 CA--C 1.529 0.145 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.583 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.495 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 72.3 Cg_endo -75.16 10.91 1.62 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.464 2.109 . . . . 0.0 111.721 179.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.721 ' O ' HG12 ' A' ' 13' ' ' VAL . 97.8 t 102.06 2.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 124.72 1.262 . . . . 0.0 110.586 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.554 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 24.8 p -60.73 -75.08 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.433 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.554 ' N ' ' OG ' ' A' ' 14' ' ' SER . 29.6 mttm -66.96 102.58 1.0 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.225 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -172.37 28.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.416 -179.423 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -115.12 37.8 3.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.255 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 20' ' ' ASN . 0.5 OUTLIER -169.37 119.16 0.67 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.792 0.33 . . . . 0.0 111.159 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.23 52.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.165 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 18' ' ' LEU . 0.6 OUTLIER -140.87 -82.37 0.23 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.725 0.298 . . . . 0.0 111.24 -179.434 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 4.3 tp-100 -38.19 -61.69 0.64 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.911 0.386 . . . . 0.0 110.826 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.81 -54.62 39.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.251 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.45 -64.13 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.792 0.329 . . . . 0.0 110.247 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 24' ' ' TYR . 0.4 OUTLIER -50.64 -39.76 51.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.89 179.238 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.1 m-20 -55.36 -58.5 7.47 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.464 ' C ' ' H ' ' A' ' 28' ' ' LEU . 61.7 m -52.39 -43.55 64.82 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -59.62 7.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.583 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.7 tp -166.35 -37.02 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.515 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.5 m-20 -66.16 -13.27 59.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.878 0.371 . . . . 0.0 110.739 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -142.34 0.4 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.1 m80 64.33 45.43 3.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.945 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.75 -178.46 5.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.255 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.64 -32.01 12.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.305 0.574 . . . . 0.0 110.065 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.2 p 178.07 146.12 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.536 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.94 -177.16 23.7 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.845 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -178.62 168.63 1.75 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 0.0 110.918 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.8 m -88.8 132.22 34.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.437 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -143.79 164.83 29.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.534 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -91.41 104.52 17.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.996 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.529 ' C ' ' H ' ' A' ' 42' ' ' LYS . 8.9 p-10 -92.34 -177.48 4.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.041 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -63.29 39.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.616 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 21.11 1.78 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.869 0.366 . . . . 0.0 110.612 179.665 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 40.54 39.83 0.8 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.159 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -144.49 159.8 42.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.569 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.573 ' O ' HG13 ' A' ' 13' ' ' VAL . 9.6 mt -85.4 94.98 9.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.688 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -90.47 139.94 30.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.396 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.646 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -83.8 93.77 8.04 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.008 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.9 mt -83.47 118.04 30.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.931 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 8' ' ' TYR . 39.7 m -97.61 112.98 24.63 Favored 'General case' 0 C--O 1.231 0.101 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.392 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -95.15 132.33 40.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 110.666 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.31 -42.69 7.27 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.548 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.609 ' O ' ' N ' ' A' ' 54' ' ' TYR . 23.0 m -108.7 -112.78 0.3 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.652 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.403 ' OE1' ' NZ ' ' A' ' 3' ' ' LYS . 12.4 tp10 38.8 -85.02 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.03 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.609 ' N ' ' O ' ' A' ' 52' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.305 -0.855 . . . . 0.0 110.35 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.575 0 CA-C-O 120.882 0.372 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -93.94 13.76 21.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.4 mtmt -119.01 123.14 43.79 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.671 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -164.36 -86.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.11 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.85 135.57 35.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.99 0.424 . . . . 0.0 111.235 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -147.89 130.52 15.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.104 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -64.44 127.68 25.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.502 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.607 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 28.8 t80 -74.56 2.55 9.44 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.253 0.549 . . . . 0.0 110.527 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.56 ' O ' ' C ' ' A' ' 10' ' ' ASN . 9.9 pt-20 32.54 -154.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.676 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.56 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 11.89 104.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.457 0.473 . . . . 0.0 111.676 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.438 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 4.6 t80 -176.81 133.23 0.38 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.099 -179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.586 ' O ' ' N ' ' A' ' 14' ' ' SER . 61.0 Cg_endo -71.0 47.28 0.73 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.128 1.885 . . . . 0.0 112.135 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.515 ' C ' ' O ' ' A' ' 12' ' ' PRO . 2.8 t 12.02 54.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.713 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 12' ' ' PRO . 74.8 p -63.58 -125.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.7 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 32.4 mttm -67.45 161.28 25.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.64 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.475 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 1.3 m -173.42 93.89 0.1 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.386 0.613 . . . . 0.0 111.34 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.475 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER 156.46 -48.02 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.782 -1.099 . . . . 0.0 108.888 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.6 mt -75.59 125.47 29.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.732 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -52.86 92.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.367 . . . . 0.0 110.672 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.551 ' CG ' ' H ' ' A' ' 21' ' ' GLN . 19.4 t-20 -173.43 -121.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.551 ' H ' ' CG ' ' A' ' 20' ' ' ASN . 14.3 mm-40 -5.17 -79.45 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.918 0.761 . . . . 0.0 112.412 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -55.72 31.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.447 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.48 ' N ' ' O ' ' A' ' 20' ' ' ASN . 4.4 t-20 -53.13 -61.62 2.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.346 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.74 -57.62 8.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.225 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -50.1 -53.67 25.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.218 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.653 ' C ' ' H ' ' A' ' 28' ' ' LEU . 84.0 m -57.69 -47.13 83.21 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.24 11.0 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.029 0.442 . . . . 0.0 110.119 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.678 ' O ' ' N ' ' A' ' 30' ' ' LYS . 9.1 tp -161.14 -137.5 0.04 OUTLIER 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 52.25 -78.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.678 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -101.32 -4.6 26.74 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 177.631 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.461 ' CD2' ' C ' ' A' ' 30' ' ' LYS . 10.5 m-70 70.19 65.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.263 178.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -90.21 -163.07 0.96 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.264 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.498 HH21 ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.08 -34.03 10.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.293 0.568 . . . . 0.0 109.654 179.472 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.498 ' CB ' HH21 ' A' ' 33' ' ' ARG . 96.5 p -176.51 -169.74 0.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.035 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -153.76 174.12 32.36 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.108 -1.044 . . . . 0.0 113.349 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -176.86 143.51 0.43 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.519 ' HB3' HD22 ' A' ' 45' ' ' LEU . 99.5 m -90.05 157.18 17.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.062 0.458 . . . . 0.0 111.985 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -147.24 142.28 27.06 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.851 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -86.29 173.19 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 111.618 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.584 ' C ' ' H ' ' A' ' 42' ' ' LYS . 29.1 p-10 -118.89 178.88 4.32 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.737 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.67 25.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.959 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.584 ' H ' ' C ' ' A' ' 40' ' ' ASP . 14.3 tppt? -145.26 -77.78 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.968 0.413 . . . . 0.0 109.932 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.614 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -179.12 12.57 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.29 179.762 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.433 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 0.6 OUTLIER -90.7 133.51 35.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.942 0.401 . . . . 0.0 110.673 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.519 HD22 ' HB3' ' A' ' 37' ' ' CYS . 6.4 mt -90.93 160.27 15.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.966 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -141.96 136.01 29.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.038 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.93 100.42 12.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.471 -179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.461 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.2 mp -89.62 116.41 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.594 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -94.78 119.26 33.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.652 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -94.07 123.17 37.28 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.571 0.7 . . . . 0.0 111.876 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.41 ' O ' ' HB2' ' A' ' 33' ' ' ARG . 11.8 m-85 -97.31 -94.43 0.22 Allowed 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.563 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.1 m 52.22 23.57 2.42 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.007 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 71.1 tt0 -41.25 101.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.095 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.508 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.635 0 CA-C-O 120.775 0.322 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -166.1 86.19 0.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.986 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 mttt 64.84 164.99 0.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.006 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.04 37.36 0.12 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.715 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.08 126.96 11.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.883 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.57 137.24 16.94 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.486 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.64 146.65 11.82 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.155 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.492 ' O ' ' CB ' ' A' ' 9' ' ' GLU . 24.5 t80 -73.36 -16.12 61.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.361 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.642 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 88.23 143.34 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.643 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.493 ' C ' ' O ' ' A' ' 9' ' ' GLU . 13.6 t-20 15.33 46.61 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.926 0.766 . . . . 0.0 112.508 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.642 ' N ' ' O ' ' A' ' 9' ' ' GLU . 39.0 t80 -59.05 122.6 64.17 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.892 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -41.43 86.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.944 1.763 . . . . 0.0 112.031 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.55 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -53.17 97.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.039 0.447 . . . . 0.0 111.392 -179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -177.59 -82.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.333 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -68.71 99.33 1.0 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.601 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.552 ' HB3' HD12 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -172.59 105.12 0.16 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.494 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 169.37 36.11 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.315 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -166.6 145.29 5.44 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.887 0.375 . . . . 0.0 111.103 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.63 55.32 0.01 OUTLIER 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.237 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.601 ' N ' ' O ' ' A' ' 18' ' ' LEU . 7.1 t-20 -148.75 -115.06 0.06 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.604 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.554 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.2 mp0 3.41 -79.76 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 O-C-N 123.74 0.65 . . . . 0.0 112.241 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -56.11 26.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.928 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -53.12 -61.26 2.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.319 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.537 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.45 -54.52 26.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.363 179.489 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.0 m-20 -51.35 -66.42 0.39 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.315 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.537 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.6 m -47.23 -43.92 22.24 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.505 -0.478 . . . . 0.0 109.94 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -59.48 8.71 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.924 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.9 tp -164.28 -36.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.758 -0.377 . . . . 0.0 111.942 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.482 ' N ' ' O ' ' A' ' 25' ' ' ASP . 15.4 m-20 -70.23 -21.42 63.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.862 0.363 . . . . 0.0 110.875 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' CG ' ' OH ' ' A' ' 51' ' ' TYR . 3.8 tptp -136.11 5.69 3.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.061 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 60.53 31.91 20.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.795 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.695 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.33 -177.73 6.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.93 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -99.08 -23.88 15.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.637 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.446 ' CB ' HD21 ' A' ' 23' ' ' ASN . 1.7 p -175.06 -165.32 0.18 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.864 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.53 -175.7 46.57 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.55 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -175.96 146.44 0.7 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.928 0.394 . . . . 0.0 111.316 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.24 105.83 18.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.527 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.462 ' CD2' HD12 ' A' ' 48' ' ' ILE . 41.0 m-85 -99.85 125.19 45.77 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.003 0.43 . . . . 0.0 112.082 -179.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.615 ' CE1' HD22 ' A' ' 45' ' ' LEU . 74.6 m-85 -73.98 174.36 8.7 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.103 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 3.0 p30 -173.52 156.15 2.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.748 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.478 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.2 pt-20 16.45 -74.53 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.872 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -99.09 45.43 1.0 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.382 -179.148 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.572 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 23.5 66.0 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.808 179.612 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.91 ' C ' HD23 ' A' ' 45' ' ' LEU . 0.6 OUTLIER -97.75 -3.76 38.42 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.91 HD23 ' C ' ' A' ' 44' ' ' ASN . 1.2 pt? 36.74 93.83 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.21 0.529 . . . . 0.0 112.018 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mp0 -94.12 138.11 32.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.803 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.449 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -77.0 98.11 4.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.809 -178.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.462 HD12 ' CD2' ' A' ' 38' ' ' PHE . 5.5 mt -86.51 114.56 26.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.708 179.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 65.6 m -91.31 117.73 29.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.467 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.695 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 6.6 t70 -95.26 127.83 41.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.0 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.454 ' OH ' ' CG ' ' A' ' 30' ' ' LYS . 39.4 m-85 -97.47 4.82 50.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.727 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.4 m -140.25 -76.22 0.33 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.408 . . . . 0.0 110.435 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.578 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 1.0 OUTLIER 50.85 16.1 0.3 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.028 179.693 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.198 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.582 0 CA-C-O 120.797 0.332 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.501 ' O ' ' O ' ' A' ' 3' ' ' LYS . 25.1 t70 53.38 41.37 32.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.879 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.501 ' O ' ' O ' ' A' ' 2' ' ' ASP . 20.1 mttp 42.5 104.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.274 0.559 . . . . 0.0 111.29 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.24 20.05 13.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.767 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.8 141.04 27.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.976 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.31 134.68 24.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.958 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -61.48 131.67 26.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.681 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.6 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -67.14 -3.03 6.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.498 ' O ' ' O ' ' A' ' 10' ' ' ASN . 4.9 mt-10 90.46 -123.41 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.905 0.753 . . . . 0.0 110.398 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.569 ' O ' ' CB ' ' A' ' 11' ' ' TYR . 10.5 m120 -53.47 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.269 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.569 ' CB ' ' O ' ' A' ' 10' ' ' ASN . 24.1 t80 102.29 137.94 0.01 OUTLIER Pre-proline 0 N--CA 1.47 0.55 0 O-C-N 123.73 0.644 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.58 83.95 1.66 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.096 1.864 . . . . 0.0 112.226 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.435 ' CG1' HD23 ' A' ' 45' ' ' LEU . 3.0 t -52.61 106.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.002 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.6 p -173.51 -80.17 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.928 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -65.99 -17.79 64.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.911 0.386 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.497 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -65.15 84.07 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.46 179.832 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.2 mm-40 -132.85 -11.39 3.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.316 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.8 mt -165.48 167.08 17.87 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.018 0.437 . . . . 0.0 110.935 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.541 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -57.28 137.1 56.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.58 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.554 ' CG ' ' N ' ' A' ' 21' ' ' GLN . 1.6 t-20 150.45 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.257 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.554 ' N ' ' CG ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -50.03 -55.18 15.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.217 179.847 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 8.0 t -59.45 -54.62 44.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.455 HD22 ' C ' ' A' ' 23' ' ' ASN . 0.4 OUTLIER -52.11 -67.84 0.22 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.762 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.558 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.11 -46.65 53.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.963 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.1 m-20 -49.2 -61.24 2.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.533 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.497 ' C ' ' H ' ' A' ' 28' ' ' LEU . 92.2 m -55.03 -42.73 72.98 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.239 -0.584 . . . . 0.0 109.587 179.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -60.17 7.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.323 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' A' ' 26' ' ' CYS . 1.2 tp -164.42 -20.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 25' ' ' ASP . 2.0 m-20 -68.27 -64.52 0.85 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.781 0.324 . . . . 0.0 110.648 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mttp -101.06 12.66 37.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.65 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.8 m170 68.3 39.35 2.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.194 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -87.72 -177.04 5.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.907 0.384 . . . . 0.0 111.323 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.67 -37.74 11.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.502 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.582 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.7 p -177.64 -140.33 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.627 0.251 . . . . 0.0 110.786 178.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.582 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 124.53 -159.31 19.16 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.727 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.77 171.8 2.18 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.35 131.83 35.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 111.567 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.502 ' O ' HD12 ' A' ' 45' ' ' LEU . 70.4 m-85 -149.42 -171.19 3.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.241 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.595 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 6.6 m-85 -90.65 141.61 28.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.944 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.572 ' C ' ' H ' ' A' ' 42' ' ' LYS . 1.3 p-10 -99.3 171.2 8.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.356 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -64.19 36.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.382 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.572 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.6 OUTLIER -143.01 8.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.057 0.456 . . . . 0.0 110.316 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' C ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 59.93 58.86 2.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.571 -179.726 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.595 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 2.3 m120 -143.82 -138.18 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.056 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 38' ' ' PHE . 27.0 tp -155.12 129.25 8.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.88 0.372 . . . . 0.0 111.414 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.484 ' OE1' ' O ' ' A' ' 45' ' ' LEU . 1.0 OUTLIER -145.76 175.81 10.12 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.214 0.531 . . . . 0.0 111.105 -179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.414 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -95.25 103.47 15.33 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.092 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 5.3 mm -83.2 113.1 21.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 111.011 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -95.91 125.42 40.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.433 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.57 ' OD1' ' N ' ' A' ' 51' ' ' TYR . 61.5 t0 -94.29 143.09 26.69 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.503 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.57 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 81.7 m-85 -129.32 31.33 4.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.302 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -94.57 -82.25 0.37 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -179.063 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.535 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 1.0 OUTLIER 86.28 -67.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.899 0.381 . . . . 0.0 110.288 -179.316 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.852 179.556 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.625 0 CA-C-O 120.876 0.369 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.5 ' O ' ' C ' ' A' ' 3' ' ' LYS . 3.2 p-10 -138.99 -117.79 0.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.181 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.515 ' C ' ' H ' ' A' ' 5' ' ' LYS . 66.8 mttt 23.12 83.28 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 O-C-N 123.398 0.436 . . . . 0.0 111.536 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 64.5 m -64.29 5.74 0.24 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.187 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.515 ' H ' ' C ' ' A' ' 3' ' ' LYS . 2.5 tptt -138.76 127.37 23.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.194 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -144.87 110.02 5.15 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.101 0.477 . . . . 0.0 111.417 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.5 m -69.36 143.49 14.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.522 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.517 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.7 OUTLIER -89.86 71.76 7.58 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.002 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.94 71.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.321 -178.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.531 ' O ' ' C ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER 177.94 -79.16 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.536 179.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.548 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.3 t80 -0.42 114.4 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.448 0 O-C-N 123.915 0.759 . . . . 0.0 112.438 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.431 ' O ' ' N ' ' A' ' 14' ' ' SER . 86.8 Cg_exo -44.11 98.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.442 ' H ' HG23 ' A' ' 13' ' ' VAL . 2.0 t -54.29 87.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.933 0.396 . . . . 0.0 111.131 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.453 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 1.7 p -176.2 139.44 0.36 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.918 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.557 ' C ' ' H ' ' A' ' 17' ' ' GLN . 0.5 OUTLIER 84.2 8.54 0.52 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 179.726 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -67.95 21.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.814 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.557 ' H ' ' C ' ' A' ' 15' ' ' LYS . 1.6 mp0 -94.93 18.27 12.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.275 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 mt -166.96 147.03 5.56 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.012 0.434 . . . . 0.0 111.18 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.444 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.52 -178.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.967 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.615 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.5 OUTLIER 80.22 -72.42 0.07 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.757 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.7 OUTLIER -54.91 77.07 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.359 179.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.615 ' N ' ' O ' ' A' ' 20' ' ' ASN . 66.8 m 125.98 -54.29 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.601 1.16 . . . . 0.0 109.04 -178.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -55.16 -54.91 37.24 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.453 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -56.18 -53.86 52.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.977 178.66 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -46.73 -51.84 15.28 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.731 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.914 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 55.6 m -59.31 -43.45 92.65 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.0 tptt -58.08 4.16 0.02 OUTLIER 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.583 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.645 ' O ' ' N ' ' A' ' 30' ' ' LYS . 6.7 tp -164.8 -124.99 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.075 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 36.88 -81.54 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.73 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.645 ' N ' ' O ' ' A' ' 28' ' ' LEU . 2.2 mptp? -92.78 14.92 15.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.868 0.366 . . . . 0.0 110.936 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.582 ' N ' ' O ' ' A' ' 28' ' ' LEU . 22.3 m170 62.97 49.71 3.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.862 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.914 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -90.37 -173.29 3.74 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.83 0.348 . . . . 0.0 110.586 179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -114.3 -31.77 6.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.828 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 25.9 p -165.99 -168.11 1.2 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.41 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . 160.68 175.22 31.45 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.353 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -176.77 176.38 1.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.111 0.481 . . . . 0.0 111.007 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.0 m -88.27 136.92 32.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.856 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -143.19 131.22 21.75 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.843 0.354 . . . . 0.0 111.664 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.571 ' CZ ' HD22 ' A' ' 45' ' ' LEU . 10.2 m-85 -72.42 166.82 21.82 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.476 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.405 ' OD1' ' N ' ' A' ' 44' ' ' ASN . 1.3 p30 -139.99 179.27 6.71 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.04 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.99 -14.78 51.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.49 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.95 5.98 49.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.988 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 18.6 ttp180 62.65 53.72 2.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.722 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.405 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 10.0 m-80 -143.95 135.55 26.04 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.962 ' H ' HD23 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -92.1 104.85 17.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.09 -179.152 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 137.86 32.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.561 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.415 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 21.1 m -82.53 104.51 12.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.105 0.478 . . . . 0.0 110.884 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.41 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 17.1 mt -87.03 124.4 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.562 -0.744 . . . . 0.0 112.779 -178.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.2 m -98.37 113.84 25.96 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.944 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 53' ' ' GLU . 8.8 t70 -93.45 154.93 17.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.013 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -126.6 -33.4 2.54 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.15 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -142.39 0.58 1.32 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 121.043 -0.263 . . . . 0.0 111.293 -179.269 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.588 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 9.6 pm0 35.36 34.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.01 0.433 . . . . 0.0 110.607 -179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.453 ' O ' ' O ' ' A' ' 53' ' ' GLU . 4.4 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.856 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 120.771 0.32 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.74 65.91 1.88 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.153 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.2 mtpt -65.17 -139.71 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.862 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.429 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 2.1 m -145.85 0.0 0.83 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.583 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -93.68 133.22 37.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.554 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.16 127.34 13.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 111.074 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.4 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.8 OUTLIER -66.58 146.04 13.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.66 179.287 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.9 OUTLIER -70.51 90.53 0.74 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.62 ' O ' ' ND2' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -62.29 74.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.241 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.62 ' ND2' ' O ' ' A' ' 9' ' ' GLU . 20.2 p30 125.15 118.65 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.728 1.211 . . . . 0.0 109.968 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 42.1 t80 178.56 140.22 0.26 Allowed Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.318 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.7 73.66 0.42 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.145 1.897 . . . . 0.0 112.43 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.42 ' H ' HG23 ' A' ' 13' ' ' VAL . 3.0 t -55.38 99.75 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.874 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.0 p -175.89 -66.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.914 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -65.57 -3.92 5.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.967 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.42 83.84 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.107 0.48 . . . . 0.0 110.631 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.652 ' H ' HD12 ' A' ' 18' ' ' LEU . 40.1 mt-30 -145.87 22.78 1.41 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.296 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.887 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -164.42 129.73 2.8 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.076 0.465 . . . . 0.0 110.447 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.27 74.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.905 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.607 ' O ' ' N ' ' A' ' 23' ' ' ASN . 12.5 t-20 -162.39 -113.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.526 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.556 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -3.18 -78.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.719 0.637 . . . . 0.0 112.098 179.648 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 13.6 t -58.89 -54.35 48.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.181 0.515 . . . . 0.0 110.786 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.607 ' N ' ' O ' ' A' ' 20' ' ' ASN . 60.3 t30 -52.17 -64.85 0.68 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.232 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.479 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.54 -41.9 61.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.257 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.441 ' OD1' ' O ' ' A' ' 21' ' ' GLN . 1.5 m-20 -54.39 -71.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.13 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.458 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -51.97 -32.18 32.32 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.248 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -59.57 0.2 0.14 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.396 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.458 ' H ' ' C ' ' A' ' 26' ' ' CYS . 8.8 tt -164.93 -26.72 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.717 0.294 . . . . 0.0 111.667 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -69.37 -52.59 25.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 110.822 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.88 11.72 34.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.492 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.8 m170 62.11 33.22 17.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.886 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.2 -179.79 6.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -29.59 13.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 110.398 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.5 p -179.13 -169.94 0.16 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.141 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 169.13 179.77 41.33 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.023 -1.084 . . . . 0.0 113.334 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -175.68 153.62 1.45 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.2 m -88.67 137.06 32.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.838 0.352 . . . . 0.0 111.212 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -147.56 152.45 37.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.45 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -57.08 -173.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.855 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 42' ' ' LYS . 26.4 p-10 -170.75 85.07 0.1 Allowed 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.187 0.518 . . . . 0.0 110.849 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 40' ' ' ASP . 4.8 pt-20 30.56 27.8 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.821 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.638 ' N ' ' O ' ' A' ' 40' ' ' ASP . 1.5 mtpt -148.59 6.11 0.72 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.727 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 66.55 -2.82 0.97 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.128 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 42' ' ' LYS . 7.8 m-80 -95.42 140.34 30.43 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.718 ' N ' HD12 ' A' ' 45' ' ' LEU . 2.3 mp -78.97 155.42 28.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.666 0.745 . . . . 0.0 112.778 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.433 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -142.95 132.95 24.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.105 179.2 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.7 m -75.52 98.57 3.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.512 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.8 mp -86.66 107.39 16.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.36 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.3 m -97.97 119.19 36.15 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.819 0.343 . . . . 0.0 111.278 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -93.86 129.91 40.1 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -95.59 -32.65 12.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.054 -179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -143.62 -84.79 0.15 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.499 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.563 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 16.8 tt0 146.7 -14.29 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.497 0.498 . . . . 0.0 110.488 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.454 ' C ' ' O ' ' A' ' 53' ' ' GLU . 3.5 m-30 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.93 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.618 0 CA-C-O 120.891 0.377 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.65 -60.62 2.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.021 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.4 mtmm -123.83 126.48 46.51 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.929 0.395 . . . . 0.0 110.891 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -91.56 8.41 36.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.186 -179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.481 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -144.51 158.26 43.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.424 179.688 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.48 119.29 6.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.042 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.68 HG23 ' H ' ' A' ' 9' ' ' GLU . 2.9 m -63.29 139.22 21.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.905 0.383 . . . . 0.0 110.985 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.544 ' CD1' ' O ' ' A' ' 8' ' ' TYR . 28.5 t80 -51.06 -5.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.808 -179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.68 ' H ' HG23 ' A' ' 7' ' ' VAL . 28.0 mt-10 91.15 6.79 0.07 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.368 0.667 . . . . 0.0 111.39 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.583 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 52.5 t-20 113.47 74.36 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 O-C-N 124.1 0.875 . . . . 0.0 111.669 179.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 22' ' ' CYS . 4.1 t80 -54.11 144.05 40.76 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.532 ' O ' ' C ' ' A' ' 13' ' ' VAL . 19.7 Cg_endo -60.13 40.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.194 1.929 . . . . 0.0 112.678 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.565 ' N ' ' O ' ' A' ' 11' ' ' TYR . 76.9 t 8.15 81.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 123.325 0.65 . . . . 0.0 112.598 179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.5 p -175.77 20.8 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -172.05 101.74 0.17 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.163 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.8 OUTLIER -170.95 1.77 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.55 -179.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.499 ' O ' HD12 ' A' ' 18' ' ' LEU . 19.3 mt-30 -78.16 50.95 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.064 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.639 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 2.2 mp -165.22 -114.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.773 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.639 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 165.67 46.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.888 0.375 . . . . 0.0 110.703 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 21' ' ' GLN . 3.2 t-20 -137.9 -63.62 0.56 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.49 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' ASN . 1.8 tp-100 -39.83 -72.23 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.866 0.365 . . . . 0.0 110.601 -179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 5.1 m -62.68 -45.18 93.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -50.34 -67.31 0.27 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.579 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.529 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.83 -50.82 55.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.113 179.527 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -43.39 -57.27 3.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.903 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 76.1 m -58.55 -45.33 89.15 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.1 tttp -57.05 0.48 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.508 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.794 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.1 tp -165.54 -131.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.501 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 35.3 -68.69 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 123.675 0.609 . . . . 0.0 112.481 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.794 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -87.47 -5.43 58.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.983 0.42 . . . . 0.0 110.098 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.547 ' N ' ' O ' ' A' ' 28' ' ' LEU . 1.6 m170 79.17 36.3 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.039 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.903 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.89 -179.69 5.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.867 0.365 . . . . 0.0 110.903 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.578 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 53.0 mtt-85 -99.55 -28.75 13.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.228 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.5 p -175.95 -159.67 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.519 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.92 -176.16 41.38 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.936 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -176.34 158.31 1.85 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.819 0.342 . . . . 0.0 110.495 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.6 m -88.88 147.91 24.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.215 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -139.3 132.24 29.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.747 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.496 ' CE2' HD12 ' A' ' 45' ' ' LEU . 48.7 m-85 -89.78 139.21 30.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.91 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.599 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER -93.48 76.42 4.44 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.096 0.474 . . . . 0.0 110.783 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' A' ' 40' ' ' ASP . 2.3 pt-20 19.02 44.94 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.631 -1.168 . . . . 0.0 112.114 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.599 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.9 mtpm? -142.3 -65.83 0.4 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.554 ' CG ' ' O ' ' A' ' 42' ' ' LYS . 2.3 mmm180 167.79 -21.82 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.915 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -87.98 172.35 9.63 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.772 HD13 ' N ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -149.53 168.97 22.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.497 0.665 . . . . 0.0 112.527 -179.199 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -135.92 141.57 44.54 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.346 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 90.3 m -92.6 103.43 15.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.108 -179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 57.7 mt -84.54 120.17 34.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.614 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.1 m -92.76 116.1 28.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.586 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -90.76 120.77 32.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.244 0.545 . . . . 0.0 111.121 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.578 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 66.5 m-85 -97.81 13.62 29.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.654 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.435 ' O ' ' N ' ' A' ' 54' ' ' TYR . 73.0 m -142.64 -102.38 0.13 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.913 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 48.62 -91.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.864 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.435 ' N ' ' O ' ' A' ' 52' ' ' CYS . 84.6 m-85 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.283 -0.865 . . . . 0.0 110.922 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 120.679 0.275 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.514 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 3.1 p30 -142.18 42.36 1.66 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.077 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.2 mmtm -79.3 121.78 25.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.69 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.401 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -94.6 8.83 40.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.382 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.26 134.26 19.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.808 0.337 . . . . 0.0 110.674 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.97 131.8 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.066 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.443 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -64.55 141.57 18.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -44.52 -85.68 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.512 ' O ' ' N ' ' A' ' 11' ' ' TYR . 2.0 mt-10 -178.07 -155.3 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.702 179.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.56 ' O ' ' C ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -39.17 -25.64 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.059 -0.256 . . . . 0.0 110.562 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.684 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 2.3 t80 1.67 91.68 0.03 OUTLIER Pre-proline 0 N--CA 1.472 0.652 0 O-C-N 123.86 0.725 . . . . 0.0 111.685 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.519 ' O ' ' C ' ' A' ' 13' ' ' VAL . 60.6 Cg_endo -74.14 59.16 4.45 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 121.836 1.69 . . . . 0.0 112.269 -179.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.756 HG22 ' N ' ' A' ' 14' ' ' SER . 7.3 p 6.83 -119.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.452 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.756 ' N ' HG22 ' A' ' 13' ' ' VAL . 1.4 p 84.83 -2.78 0.93 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.039 0.447 . . . . 0.0 110.06 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.436 ' CG ' ' C ' ' A' ' 14' ' ' SER . 2.4 mttt -164.41 108.7 0.95 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.327 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -172.67 97.7 0.14 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.046 0.451 . . . . 0.0 111.142 179.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.483 ' CG ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mt-30 -172.71 23.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.304 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.82 146.33 5.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.525 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.26 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.133 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.58 ' O ' ' N ' ' A' ' 23' ' ' ASN . 4.1 t-20 -173.8 -132.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.061 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.529 ' C ' ' O ' ' A' ' 20' ' ' ASN . 13.4 mm-40 8.32 -87.43 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.979 0.8 . . . . 0.0 112.379 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.645 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 39.6 m -53.46 -56.68 14.85 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.955 0.407 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.58 ' N ' ' O ' ' A' ' 20' ' ' ASN . 2.5 t30 -52.46 -64.79 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.488 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -51.91 -50.97 60.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.135 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' A' ' 29' ' ' ASP . 67.8 m-20 -51.39 -60.27 3.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.889 -179.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.445 ' C ' ' H ' ' A' ' 28' ' ' LEU . 66.9 m -54.51 -41.38 69.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.037 0.446 . . . . 0.0 110.169 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.516 ' HA ' ' HZ3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -59.48 3.75 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.17 -179.608 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.9 tt -163.27 -36.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.285 -0.566 . . . . 0.0 112.324 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 25' ' ' ASP . 85.4 m-20 -68.07 -44.07 77.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.801 0.334 . . . . 0.0 110.662 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.6 10.73 26.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m80 42.37 48.21 4.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.059 0.457 . . . . 0.0 110.008 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.582 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -85.97 -177.69 6.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.655 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.597 ' NE ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -101.67 -30.11 11.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.046 0.45 . . . . 0.0 110.343 179.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.584 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.2 OUTLIER -172.99 155.19 3.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.278 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.484 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 165.04 175.17 35.51 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.547 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.545 ' CG ' ' CZ ' ' A' ' 38' ' ' PHE . 10.8 pt-20 -178.2 -162.64 0.06 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.781 0.324 . . . . 0.0 110.734 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -87.06 129.22 35.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.279 179.475 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.545 ' CZ ' ' CG ' ' A' ' 36' ' ' GLU . 34.7 m-85 -147.05 167.07 24.98 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.334 0.587 . . . . 0.0 111.857 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.695 ' CE1' HD13 ' A' ' 45' ' ' LEU . 65.0 m-85 -98.17 -117.59 0.14 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.801 178.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.526 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.1 OUTLIER 51.4 149.55 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.42 0.629 . . . . 0.0 112.014 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.471 ' CG ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 89.41 -56.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.474 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.473 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 1.9 ttmt -149.63 30.61 0.74 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 54.72 18.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.995 0.426 . . . . 0.0 110.311 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.473 ' OD1' ' O ' ' A' ' 42' ' ' LYS . 6.6 m-20 -95.75 125.5 40.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.697 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.695 HD13 ' CE1' ' A' ' 39' ' ' TYR . 6.6 tp -85.78 112.4 21.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.813 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -142.22 161.32 38.31 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 112.23 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.684 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 73.0 m -75.62 96.66 3.6 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.873 -179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.3 mt -90.27 117.17 33.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.358 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 59.7 m -93.48 110.53 22.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.038 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.584 ' N ' ' O ' ' A' ' 34' ' ' SER . 0.9 OUTLIER -93.1 160.67 14.75 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.786 0.803 . . . . 0.0 112.265 -178.993 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.401 ' N ' ' O ' ' A' ' 4' ' ' CYS . 87.4 m-85 -128.35 -28.41 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.209 -179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 57.2 m -98.58 -3.09 37.04 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.749 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 74.71 -83.93 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.128 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.047 -179.851 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.547 0 CA-C-O 120.794 0.33 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 50.74 -172.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.652 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.505 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 3.3 mmtt -97.55 125.62 42.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.705 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.505 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.1 m 165.86 23.23 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.172 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.85 154.87 43.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.726 0.298 . . . . 0.0 110.765 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 tttt -151.12 121.14 7.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.293 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.582 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -63.06 116.35 2.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.564 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.557 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -55.52 76.45 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.129 -179.476 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 7' ' ' VAL . 50.5 mt-10 8.81 117.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.511 ' C ' ' O ' ' A' ' 9' ' ' GLU . 6.0 m-20 14.47 52.53 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.613 ' O ' ' N ' ' A' ' 13' ' ' VAL . 87.4 t80 -54.6 136.61 62.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 179.052 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.414 ' HD2' ' CD1' ' A' ' 11' ' ' TYR . 76.6 Cg_exo -40.43 84.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 121.852 1.701 . . . . 0.0 111.768 179.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -56.61 106.86 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.53 -179.061 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 89.2 p -175.75 -86.55 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.06 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.581 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -69.59 159.28 33.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.949 178.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.581 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.0 m -170.58 -79.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.678 0.275 . . . . 0.0 111.393 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' LEU . 2.4 mp0 63.08 13.22 6.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.151 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.62 HD12 ' N ' ' A' ' 18' ' ' LEU . 4.4 mp 28.38 57.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.325 179.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 173.86 35.53 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.03 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.574 ' O ' ' N ' ' A' ' 23' ' ' ASN . 1.2 t-20 -174.5 -118.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.676 ' H ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -1.01 -83.62 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.997 0.811 . . . . 0.0 112.209 179.534 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 0.3 OUTLIER -58.57 -50.78 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.256 -179.755 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -51.55 -69.04 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.931 0.396 . . . . 0.0 110.51 -179.782 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.47 -47.12 66.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.935 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 29' ' ' ASP . 94.9 m-20 -56.9 -67.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.602 -179.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 28' ' ' LEU . 4.3 m -50.42 -40.52 50.46 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.227 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -58.91 5.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.665 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.649 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.2 tm? -163.46 -40.92 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.878 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 25' ' ' ASP . 32.4 m-20 -68.21 -53.07 27.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.746 0.307 . . . . 0.0 111.298 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -99.74 18.63 17.68 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.904 0.383 . . . . 0.0 111.097 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 41.46 35.65 0.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.886 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.502 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.44 -171.91 3.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.16 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -95.17 -48.0 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.825 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.476 ' O ' ' OD2' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -163.48 145.8 9.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.076 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.4 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -114.91 178.21 17.79 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.895 -0.669 . . . . 0.0 113.314 -179.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.4 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 4.8 mt-10 -174.66 139.98 0.57 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.66 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 0.9 OUTLIER -88.78 145.28 25.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.761 0.315 . . . . 0.0 110.896 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -144.04 142.16 30.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.929 0.395 . . . . 0.0 110.718 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.535 ' CE2' HD21 ' A' ' 45' ' ' LEU . 63.2 m-85 -72.21 -177.7 2.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.866 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.589 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.3 OUTLIER 163.35 -172.2 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.419 0.628 . . . . 0.0 111.195 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.465 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.8 OUTLIER 24.95 -82.23 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.143 -179.365 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.604 ' N ' ' OD1' ' A' ' 44' ' ' ASN . 26.2 mmtt -134.26 79.29 1.8 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.831 0.348 . . . . 0.0 111.645 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 46.65 28.38 0.78 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.121 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.604 ' OD1' ' N ' ' A' ' 42' ' ' LYS . 1.0 OUTLIER -94.44 122.83 37.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.622 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.535 HD21 ' CE2' ' A' ' 39' ' ' TYR . 12.1 mt -89.08 109.11 20.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.685 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -93.22 135.84 34.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.657 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.487 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.3 m -77.21 100.97 5.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.469 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -86.78 116.73 29.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.556 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 99.2 m -93.76 111.47 23.17 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.865 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.502 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -88.0 143.32 27.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.524 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -112.46 -3.9 14.34 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.86 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.9 m -140.04 -118.25 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.741 0.305 . . . . 0.0 110.761 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 179.03 19.57 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.022 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.946 -179.465 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.65 0 CA-C-O 120.888 0.375 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.443 ' O ' ' CB ' ' A' ' 3' ' ' LYS . 1.0 OUTLIER -72.21 -101.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.333 179.638 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.581 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER 161.46 83.87 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.766 179.667 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.581 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.3 m 160.05 37.81 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.657 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -146.01 139.17 25.92 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.032 0.444 . . . . 0.0 111.55 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.432 ' NZ ' ' OH ' ' A' ' 51' ' ' TYR . 25.8 pttt -151.77 140.72 21.08 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.754 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.511 HG12 ' OE1' ' A' ' 46' ' ' GLN . 0.8 OUTLIER -59.98 154.94 3.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-O 121.22 0.533 . . . . 0.0 111.818 -178.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.714 ' CE2' ' CZ ' ' A' ' 11' ' ' TYR . 57.1 t80 -91.05 -16.77 27.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.602 -178.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.53 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.0 OUTLIER 22.48 110.97 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.141 -0.936 . . . . 0.0 113.367 179.568 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 11' ' ' TYR . 1.4 t-20 170.27 -71.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 177.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.714 ' CZ ' ' CE2' ' A' ' 8' ' ' TYR . 0.5 OUTLIER -46.72 173.54 0.04 OUTLIER Pre-proline 0 C--O 1.231 0.087 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.708 179.73 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.74 ' O ' HG12 ' A' ' 13' ' ' VAL . 16.7 Cg_exo -66.05 -14.84 46.28 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.358 1.372 . . . . 0.0 110.189 178.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.74 HG12 ' O ' ' A' ' 12' ' ' PRO . 1.9 p 103.94 -20.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.224 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.78 -33.67 75.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.682 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -69.19 147.26 51.57 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 110.57 179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.47 ' SG ' HD22 ' A' ' 45' ' ' LEU . 0.5 OUTLIER -175.55 -75.74 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 -179.887 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 49.56 29.91 3.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.2 0.524 . . . . 0.0 110.072 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.3 mt 44.69 -133.45 0.75 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.408 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.23 80.18 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.562 ' O ' ' N ' ' A' ' 22' ' ' CYS . 1.8 t-20 -176.83 -117.14 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.902 0.382 . . . . 0.0 111.69 179.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.591 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 1.8 tp60 -57.73 54.01 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.339 -0.846 . . . . 0.0 112.277 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.591 ' SG ' ' O ' ' A' ' 21' ' ' GLN . 1.7 m 177.8 -58.79 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.529 HD22 ' C ' ' A' ' 23' ' ' ASN . 0.2 OUTLIER -59.19 -52.0 67.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.387 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -48.9 78.88 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.879 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.499 ' OD1' ' N ' ' A' ' 22' ' ' CYS . 3.7 m-20 -52.8 -53.91 41.63 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.348 179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 28' ' ' LEU . 71.7 m -53.39 -46.62 69.75 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.4 13.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.511 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 26' ' ' CYS . 52.7 tp -165.27 -36.37 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.415 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -68.62 -44.43 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.623 0.249 . . . . 0.0 111.021 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.471 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 42.2 mmtt -107.79 -0.16 21.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.195 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.471 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER 75.78 35.7 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -87.13 177.39 7.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.213 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -107.43 -5.37 17.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.577 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.406 ' O ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER 174.39 -169.26 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.365 -179.815 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.502 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . -173.65 -165.03 29.8 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.636 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.502 ' CG ' ' O ' ' A' ' 35' ' ' GLY . 2.0 mt-10 -176.44 -164.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 110.366 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.4 m -144.17 132.35 21.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.628 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.788 ' CD2' HD12 ' A' ' 48' ' ' ILE . 97.8 m-85 -146.62 169.86 18.11 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.071 0.462 . . . . 0.0 111.531 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.614 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.0 m-85 -100.84 120.15 39.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.639 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.681 ' O ' ' N ' ' A' ' 42' ' ' LYS . 5.3 p-10 -122.65 123.38 41.02 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 40' ' ' ASP . 15.2 tt0 21.74 35.17 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.855 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.681 ' N ' ' O ' ' A' ' 40' ' ' ASP . 19.4 mtmm -147.1 -6.24 0.5 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.687 0.279 . . . . 0.0 111.34 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 31.6 mmt-85 57.56 10.08 0.93 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.008 0.432 . . . . 0.0 110.049 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 10.2 m-20 -94.73 -130.91 0.15 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.303 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.682 ' O ' HG22 ' A' ' 13' ' ' VAL . 2.3 mt -152.95 95.17 1.94 Allowed 'General case' 0 C--O 1.232 0.158 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.511 ' OE1' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -89.7 156.1 18.77 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 178.702 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 13.3 m -106.65 115.18 29.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.062 0.458 . . . . 0.0 111.292 -178.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.788 HD12 ' CD2' ' A' ' 38' ' ' PHE . 23.0 mt -88.93 132.29 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.727 -178.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 92.1 m -100.38 112.47 24.82 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.005 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.471 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.4 OUTLIER -94.24 140.51 29.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.203 0.525 . . . . 0.0 111.302 -179.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.432 ' OH ' ' NZ ' ' A' ' 6' ' ' LYS . 71.7 m-85 -113.46 -24.91 9.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.167 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -145.16 64.04 1.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.174 -179.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -86.15 31.98 0.63 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.832 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.192 -0.908 . . . . 0.0 110.927 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.579 0 CA-C-O 120.814 0.34 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' A' ' 3' ' ' LYS . 2.9 m-20 -144.41 143.6 31.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.741 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 2' ' ' ASP . 5.0 mttp -38.66 106.42 0.05 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.83 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -179.65 21.59 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.992 -179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -118.11 134.14 55.27 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.858 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -149.22 125.49 10.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.998 0.428 . . . . 0.0 111.27 179.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -61.33 144.27 14.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.434 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.51 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.5 t80 -84.68 61.89 7.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.301 -0.408 . . . . 0.0 109.926 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.637 ' O ' ' N ' ' A' ' 11' ' ' TYR . 4.1 mm-40 32.94 -159.63 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.625 -179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -58.73 44.34 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.207 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.637 ' N ' ' O ' ' A' ' 9' ' ' GLU . 7.0 t80 -52.92 134.41 48.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.552 ' C ' ' H ' ' A' ' 14' ' ' SER . 84.6 Cg_exo -39.32 85.54 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.156 1.904 . . . . 0.0 112.475 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.573 ' N ' ' O ' ' A' ' 11' ' ' TYR . 9.6 p -57.48 1.3 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.401 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.552 ' H ' ' C ' ' A' ' 12' ' ' PRO . 35.7 p -62.94 -95.85 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.286 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.66 113.79 5.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.007 0.432 . . . . 0.0 111.447 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -175.06 108.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.205 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -143.24 -23.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.674 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.13 -178.94 4.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.121 0.486 . . . . 0.0 110.961 -179.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.43 112.1 1.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.57 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.407 ' OD1' ' OE1' ' A' ' 21' ' ' GLN . 0.8 OUTLIER -175.55 -105.66 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.782 179.42 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.494 ' O ' ' OD2' ' A' ' 25' ' ' ASP . 9.6 mm100 -50.05 -55.89 12.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.851 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.7 t -55.7 -57.38 12.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.26 -179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -51.45 -64.88 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.874 0.368 . . . . 0.0 110.625 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.552 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.69 -47.03 64.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.326 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.555 ' O ' ' N ' ' A' ' 29' ' ' ASP . 20.1 m-20 -52.12 -64.71 0.73 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.985 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.5 ' C ' ' H ' ' A' ' 28' ' ' LEU . 89.9 m -51.32 -50.32 59.63 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.0 tttm -61.87 14.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.712 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.3 tm? -163.73 -41.01 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.42 -0.512 . . . . 0.0 112.265 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.555 ' N ' ' O ' ' A' ' 25' ' ' ASP . 3.5 m-20 -67.43 -47.61 69.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.1 mtpm? -101.25 6.53 42.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.829 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.401 ' CD2' ' N ' ' A' ' 31' ' ' HIS . 0.1 OUTLIER 58.15 36.66 26.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.535 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.75 -174.77 5.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.038 0.447 . . . . 0.0 111.467 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.4 tpt85 -93.87 -25.96 17.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 94.7 p -176.35 -164.11 0.11 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.287 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 159.83 176.02 31.45 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.792 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -177.0 164.43 2.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.768 0.318 . . . . 0.0 110.437 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 136.82 33.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.872 0.368 . . . . 0.0 110.519 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -146.73 162.16 39.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.876 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 23.0 m-85 -86.07 175.95 8.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.03 0.443 . . . . 0.0 111.462 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.596 ' CG ' HD22 ' A' ' 44' ' ' ASN . 17.9 p-10 -109.41 173.21 6.42 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.322 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' OE1' ' N ' ' A' ' 41' ' ' GLU . 53.0 mp0 -65.14 27.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.673 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.595 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -143.96 -74.15 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.652 -0.249 . . . . 0.0 110.571 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.467 ' O ' ' CG ' ' A' ' 43' ' ' ARG . 0.4 OUTLIER 169.71 70.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.387 179.631 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.6 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 70.8 m-80 -141.61 -155.42 0.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.428 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.55 137.05 21.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.807 0.337 . . . . 0.0 110.608 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -146.97 139.69 25.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.586 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -82.65 100.2 10.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.318 179.517 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.2 mm -82.89 112.58 20.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.556 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.7 m -95.76 117.51 30.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.227 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.505 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.1 OUTLIER -95.01 143.65 26.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.929 0.395 . . . . 0.0 110.727 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -114.23 -26.67 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.611 -179.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.482 ' O ' ' O ' ' A' ' 53' ' ' GLU . 62.2 m -95.06 -111.15 0.13 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.743 0.306 . . . . 0.0 110.887 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.487 ' O ' ' OE1' ' A' ' 53' ' ' GLU . 1.0 OUTLIER 49.66 107.57 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.884 -179.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.861 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.551 0 CA-C-O 120.755 0.312 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.42 ' O ' ' C ' ' A' ' 3' ' ' LYS . 5.3 t0 -165.51 -39.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.923 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 2' ' ' ASP . 12.2 ttmt -37.0 133.19 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.751 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 15.2 m -94.94 5.83 50.8 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.047 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.61 153.35 40.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.763 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -149.71 128.92 12.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.116 0.484 . . . . 0.0 111.638 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.409 HG12 HD11 ' A' ' 48' ' ' ILE . 5.6 m -64.34 146.3 13.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.615 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.75 76.96 7.15 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.559 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.5 pt-20 -61.58 82.54 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.416 -178.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 1.3 t-20 153.73 -2.82 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.286 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.639 ' CE1' ' SG ' ' A' ' 47' ' ' CYS . 3.9 t80 -55.83 129.43 71.64 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 119.576 -0.249 . . . . 0.0 111.632 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.535 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.4 Cg_exo -59.77 45.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 121.91 1.74 . . . . 0.0 113.256 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 11' ' ' TYR . 36.0 t 2.97 93.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 123.705 0.628 . . . . 0.0 112.665 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.504 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 85.1 p -171.22 -97.41 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.154 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.504 ' N ' ' OG ' ' A' ' 14' ' ' SER . 18.0 tttp -63.93 117.11 6.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.95 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -172.0 -12.0 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.478 0.548 . . . . 0.0 112.478 -179.019 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.41 ' H ' ' HG2' ' A' ' 17' ' ' GLN . 14.8 mm-40 -80.39 33.18 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.597 0.237 . . . . 0.0 110.79 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.4 ' H ' ' C ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -166.96 116.97 0.88 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.724 -179.672 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.77 99.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.654 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.491 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.6 OUTLIER -168.82 -86.78 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.148 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -45.55 -61.0 1.87 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.306 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.574 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.6 t -58.16 -54.46 46.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.43 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.443 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 2.2 t30 -51.03 -63.4 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.595 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.497 ' CD1' ' C ' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.44 -47.94 62.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.243 179.312 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 29' ' ' ASP . 14.6 m-20 -50.81 -62.6 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.927 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.506 ' C ' ' H ' ' A' ' 28' ' ' LEU . 80.4 m -53.85 -41.4 67.4 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.2 tptp -59.99 7.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.063 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.506 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -162.36 -40.06 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 120.588 -0.445 . . . . 0.0 112.045 -179.375 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.506 ' N ' ' O ' ' A' ' 25' ' ' ASP . 71.8 m-20 -67.35 -54.28 21.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.767 0.318 . . . . 0.0 111.004 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 1.3 mmmm -102.25 29.9 4.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.888 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 7.9 m170 33.09 39.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.427 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.671 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -89.01 -176.11 5.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.678 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -95.92 -26.12 15.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.07 0.462 . . . . 0.0 110.458 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.451 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 1.0 OUTLIER -175.17 -159.14 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.07 -179.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.451 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 164.72 -172.0 40.32 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.978 -1.106 . . . . 0.0 113.456 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.574 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 4.9 tt0 -177.07 -144.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.914 0.388 . . . . 0.0 110.521 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.09 133.84 17.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.648 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -149.66 -177.96 6.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.222 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -90.31 -166.79 1.67 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.863 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.471 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -176.41 -173.07 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.612 -179.755 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -60.52 -2.57 0.52 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.399 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.528 ' C ' ' H ' ' A' ' 44' ' ' ASN . 6.0 mmtp -100.81 -1.43 34.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.086 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 59.47 -2.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.243 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.528 ' H ' ' C ' ' A' ' 42' ' ' LYS . 2.1 m120 -94.97 158.81 15.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.695 0.283 . . . . 0.0 110.749 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.4 mt -87.84 133.2 33.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -146.5 157.2 43.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.187 0.518 . . . . 0.0 111.363 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.639 ' SG ' ' CE1' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -70.77 157.33 38.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.121 -179.72 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.409 HD11 HG12 ' A' ' 7' ' ' VAL . 0.9 OUTLIER -143.43 111.85 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.953 -179.819 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 71.8 m -92.22 119.0 31.42 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.887 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.671 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 1.7 t70 -92.7 158.39 15.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.441 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -129.92 -36.11 1.59 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.106 -179.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 34.5 m -97.54 -113.39 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.918 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 54' ' ' TYR . 76.5 mm-40 -131.31 -118.62 0.22 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.628 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.47 ' O ' ' O ' ' A' ' 53' ' ' GLU . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.022 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . 0.403 ' O ' ' CB ' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.447 -0.625 0 CA-C-O 120.861 0.362 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.403 ' CB ' ' O ' ' A' ' 1' ' ' PCA . 9.2 t0 75.49 -1.22 3.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.565 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -110.64 -5.1 15.11 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.944 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.8 m -157.77 50.28 0.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.378 . . . . 0.0 110.986 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.26 138.4 26.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.939 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.556 ' C ' HG12 ' A' ' 7' ' ' VAL . 3.6 mtpm? -147.84 -156.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.128 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.556 HG12 ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -168.52 158.84 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.627 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.13 114.31 22.16 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.034 -179.799 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -65.42 4.91 0.47 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.412 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.627 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 9.3 p30 178.23 136.96 0.08 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.727 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.6 t80 -179.42 100.92 0.19 Allowed Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.928 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.642 ' O ' ' N ' ' A' ' 14' ' ' SER . 80.7 Cg_exo -45.39 65.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.885 2.39 . . . . 0.0 113.624 -178.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.727 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.4 t 8.98 51.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 C-N-CA 123.967 0.907 . . . . 0.0 113.297 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.642 ' N ' ' O ' ' A' ' 12' ' ' PRO . 2.8 p -68.7 135.64 51.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.196 0.522 . . . . 0.0 111.915 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 tptm 26.66 32.37 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.579 ' N ' ' O ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -71.52 82.05 0.81 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.469 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -161.53 -42.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.977 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -73.06 -103.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.501 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.52 22.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.506 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.591 ' O ' ' N ' ' A' ' 22' ' ' CYS . 18.5 t-20 -114.59 -112.16 0.34 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.021 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.563 ' C ' ' O ' ' A' ' 20' ' ' ASN . 11.6 mm-40 0.89 -68.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.775 0.672 . . . . 0.0 111.827 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.591 ' N ' ' O ' ' A' ' 20' ' ' ASN . 42.7 t -60.94 -68.15 0.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.694 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.5 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -47.17 -46.96 23.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.226 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.05 -48.97 78.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.096 178.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -52.37 -57.0 11.2 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.393 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.648 ' C ' ' H ' ' A' ' 28' ' ' LEU . 91.6 m -58.13 -44.05 87.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -61.43 11.52 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.54 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.699 ' O ' ' N ' ' A' ' 30' ' ' LYS . 7.2 tp -160.89 -134.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.071 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 40.41 -76.87 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.175 0.297 . . . . 0.0 111.77 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 28' ' ' LEU . 9.9 mmtp -90.6 -9.16 48.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 110.557 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.455 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 3.3 m170 79.91 49.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.206 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.642 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.92 -136.57 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.157 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.1 mtt180 -141.45 -53.63 0.46 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.665 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -155.92 133.34 10.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.641 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.45 ' CA ' ' O ' ' A' ' 48' ' ' ILE . . . -105.98 -157.19 22.04 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.659 -0.782 . . . . 0.0 113.5 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -172.14 131.54 0.63 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 87.2 m -90.36 123.3 33.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.724 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.442 ' CE1' HG13 ' A' ' 48' ' ' ILE . 23.2 p90 -149.16 140.7 23.39 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 120.513 -0.475 . . . . 0.0 112.017 -179.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.51 ' HA ' ' H ' ' A' ' 45' ' ' LEU . 59.5 m-85 -72.69 133.87 44.8 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.66 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 42' ' ' LYS . 13.1 p-10 -146.68 -166.13 2.41 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.458 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.488 ' C ' ' O ' ' A' ' 40' ' ' ASP . 1.4 tt0 22.23 42.83 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.186 -178.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.58 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.2 mtpt 68.96 83.05 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.207 178.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.4 ttp85 61.54 52.73 3.56 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.693 -1.139 . . . . 0.0 112.002 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -93.34 -60.31 1.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.51 ' H ' ' HA ' ' A' ' 39' ' ' TYR . 11.9 tp 76.92 67.19 0.05 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.296 -178.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -91.87 -175.96 4.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.015 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 1.4 m -127.27 123.56 36.74 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -178.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.534 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -87.58 155.05 3.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 177.499 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.3 m -135.28 108.7 7.85 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 111.039 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -94.29 134.77 36.42 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -101.36 -24.67 14.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.93 -179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.476 ' O ' ' OE2' ' A' ' 53' ' ' GLU . 4.1 m -139.98 -116.89 0.13 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.019 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.476 ' OE2' ' O ' ' A' ' 52' ' ' CYS . 0.1 OUTLIER 157.6 -107.52 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.046 0.451 . . . . 0.0 110.656 179.425 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.459 ' H ' ' CG ' ' A' ' 53' ' ' GLU . 95.3 m-85 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.999 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 CA-C-O 120.954 0.407 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -148.81 153.05 37.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.587 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.1 tptp -104.67 113.18 26.59 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.144 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.6 m -96.25 -0.48 49.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.346 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.466 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -118.38 126.89 53.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.914 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.45 138.03 47.48 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.069 0.462 . . . . 0.0 111.787 -178.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.739 HG23 ' H ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -61.41 146.98 11.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.62 179.375 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.609 ' CG ' ' O ' ' A' ' 8' ' ' TYR . 2.2 t80 -92.11 42.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.962 0.41 . . . . 0.0 110.429 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.739 ' H ' HG23 ' A' ' 7' ' ' VAL . 4.5 pt-20 17.83 76.96 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.031 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.543 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 7.3 m120 103.74 145.41 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.059 0.849 . . . . 0.0 110.827 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 13' ' ' VAL . 39.4 t80 -179.32 123.7 0.24 Allowed Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.421 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_exo -41.75 82.77 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.293 1.995 . . . . 0.0 112.733 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.575 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.1 t -55.21 95.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.869 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.1 p -175.26 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.942 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -26.3 68.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.101 0.477 . . . . 0.0 110.123 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.449 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -68.09 90.49 0.33 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.735 179.236 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.654 ' H ' HD12 ' A' ' 18' ' ' LEU . 30.2 mt-30 -158.29 21.4 0.24 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.652 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.916 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -165.69 -79.55 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.739 0.304 . . . . 0.0 111.044 -179.588 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -178.01 -159.83 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 -178.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.505 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER 60.83 -72.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.381 -179.462 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.545 ' N ' ' O ' ' A' ' 19' ' ' ALA . 6.0 mm-40 -39.49 -76.11 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.6 t -59.57 -46.41 88.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.704 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -76.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.234 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.497 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.58 -43.33 35.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.467 179.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 29' ' ' ASP . 46.0 m-20 -50.37 -60.54 2.89 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.542 ' C ' ' H ' ' A' ' 28' ' ' LEU . 81.9 m -55.97 -39.53 71.94 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.275 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -59.69 7.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.836 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.542 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.8 tt -163.35 -26.07 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.638 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 25' ' ' ASP . 17.8 m-20 -70.03 -51.81 29.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.866 0.365 . . . . 0.0 110.649 179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.402 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 3.7 mmmm -110.21 0.24 18.1 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.969 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.499 ' N ' ' CD2' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 66.75 41.53 2.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.429 -179.594 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.535 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -85.83 -178.61 6.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.365 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -95.65 -10.57 29.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.071 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.4 ' OG ' ' OE1' ' A' ' 53' ' ' GLU . 0.0 OUTLIER 174.67 -169.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.987 179.992 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.71 170.24 37.61 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.304 -0.951 . . . . 0.0 112.835 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.04 153.19 0.78 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -88.43 137.16 32.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.569 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -146.4 159.99 42.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -69.65 -168.64 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.612 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -161.64 156.69 23.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.461 0.648 . . . . 0.0 112.67 -179.782 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 40' ' ' ASP . 5.1 mm-40 11.73 -69.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.378 -1.283 . . . . 0.0 114.137 179.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.612 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -88.75 -57.1 3.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.388 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER 164.25 31.44 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.903 0.382 . . . . 0.0 110.02 -179.738 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.508 HD22 ' N ' ' A' ' 44' ' ' ASN . 0.9 OUTLIER -94.68 135.77 35.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.594 179.458 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.586 HD13 ' N ' ' A' ' 46' ' ' GLN . 1.9 tm? -86.43 131.93 34.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.179 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.586 ' N ' HD13 ' A' ' 45' ' ' LEU . 38.1 mt-30 -142.25 165.47 27.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.543 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.458 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -97.19 103.69 15.65 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.413 -179.494 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.558 ' N ' HD13 ' A' ' 48' ' ' ILE . 1.9 mm -93.69 119.81 42.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 91.1 m -94.49 123.37 37.87 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.208 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.566 ' OD1' ' N ' ' A' ' 53' ' ' GLU . 15.1 t70 -94.67 136.9 34.44 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.179 0.514 . . . . 0.0 111.373 -179.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -110.68 -9.61 14.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.56 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 3.7 m -135.23 -43.76 0.71 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.566 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 13.1 tp10 82.56 -64.1 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.046 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.558 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 120.84 0.352 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.5 t70 42.79 36.92 0.92 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.98 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -169.68 167.36 9.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.487 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 62.9 m -146.02 -3.65 0.66 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.412 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.15 118.95 37.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.451 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.7 mttm -149.82 115.8 5.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.053 0.454 . . . . 0.0 112.103 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.431 HG12 HG12 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -70.69 148.0 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.701 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 178.745 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.683 ' CD1' ' ND2' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -103.96 -7.44 20.37 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.027 179.58 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 8' ' ' TYR . 2.0 tm-20 30.23 104.82 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.105 -0.952 . . . . 0.0 112.095 -178.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.779 HD22 ' N ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER 170.5 -44.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.264 179.003 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.779 ' N ' HD22 ' A' ' 10' ' ' ASN . 55.0 t80 -53.62 139.37 49.98 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.737 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 14' ' ' SER . 94.5 Cg_exo -39.59 95.93 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.081 1.854 . . . . 0.0 112.058 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.2 p -53.02 -7.17 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.106 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 12' ' ' PRO . 96.9 p -65.25 -88.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.082 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.472 ' N ' ' OG ' ' A' ' 14' ' ' SER . 35.8 tptt -66.02 139.65 58.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.756 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.75 22.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.915 0.388 . . . . 0.0 110.974 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -113.77 57.1 0.69 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.185 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.593 ' O ' ' N ' ' A' ' 20' ' ' ASN . 1.1 mt -168.88 124.99 0.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.96 54.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.552 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.593 ' N ' ' O ' ' A' ' 18' ' ' LEU . 9.8 t-20 -159.82 -73.81 0.07 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.442 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.581 ' O ' ' CB ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -53.05 90.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.969 179.299 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.581 ' CB ' ' O ' ' A' ' 21' ' ' GLN . 52.3 t 120.61 -57.95 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.613 1.196 . . . . 0.0 109.878 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 0.1 OUTLIER -56.5 -54.7 42.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.031 0.443 . . . . 0.0 109.854 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.519 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -55.18 -48.2 74.14 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.185 179.147 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.595 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -53.09 -51.27 62.4 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.069 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.819 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 22.2 m -56.27 -44.31 79.64 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.6 tttp -60.76 12.27 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.132 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.648 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.2 OUTLIER -162.16 -129.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.664 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.576 ' H ' HD12 ' A' ' 28' ' ' LEU . 0.4 OUTLIER 40.05 -81.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.706 0.289 . . . . 0.0 111.292 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.648 ' N ' ' O ' ' A' ' 28' ' ' LEU . 18.0 mttm -95.3 5.25 52.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.5 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.563 ' N ' ' O ' ' A' ' 28' ' ' LEU . 3.3 m170 71.94 56.47 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.819 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.58 177.53 6.52 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.494 ' O ' ' CB ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -96.78 -21.83 17.31 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.094 0.473 . . . . 0.0 109.864 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.494 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 1.5 p 158.59 137.86 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.049 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.439 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -128.67 -173.17 13.36 Favored Glycine 0 CA--C 1.51 -0.221 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.398 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -179.0 158.95 0.96 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 0.0 110.531 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.8 m -87.17 138.51 31.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.579 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -138.24 157.48 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.876 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.628 ' CE1' HD21 ' A' ' 45' ' ' LEU . 68.1 m-85 -93.22 -169.76 2.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.794 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.554 ' C ' ' H ' ' A' ' 42' ' ' LYS . 30.2 p30 -166.58 -172.3 2.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.852 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -65.04 18.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.827 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.554 ' H ' ' C ' ' A' ' 40' ' ' ASP . 12.3 mmtp -138.25 17.89 2.78 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.929 0.395 . . . . 0.0 111.043 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.11 13.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.463 179.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.404 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 91.2 m-20 -94.67 141.33 28.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.808 0.337 . . . . 0.0 111.166 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.628 HD21 ' CE1' ' A' ' 39' ' ' TYR . 16.7 mt -87.78 147.35 25.21 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.943 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.404 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 2.5 mp0 -147.05 134.49 20.8 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.29 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . 1.5 m -77.42 102.19 6.73 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.435 0.636 . . . . 0.0 112.391 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.431 HG12 HG12 ' A' ' 7' ' ' VAL . 5.0 mt -89.28 117.34 32.44 Favored 'Isoleucine or valine' 0 C--N 1.341 0.208 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.077 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.2 m -93.97 115.61 27.98 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 110.101 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.465 ' OD2' ' O ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -98.05 129.24 44.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.447 0.642 . . . . 0.0 110.597 179.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -102.38 -12.41 17.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.001 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.8 m -145.78 83.57 1.65 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.051 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.444 ' O ' ' O ' ' A' ' 54' ' ' TYR . 3.3 tt0 -164.07 72.67 0.25 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.844 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' GLU . 34.9 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.871 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.644 0 CA-C-O 120.661 0.267 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.14 155.0 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.852 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.12 17.03 10.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.624 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.2 m -157.96 13.72 0.21 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.32 -179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.9 pttt -146.26 131.47 18.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.852 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 mmtp -145.44 124.94 13.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.409 . . . . 0.0 111.088 -179.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.04 129.28 24.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.43 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -62.97 -79.55 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.604 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.9 OUTLIER 176.13 -173.43 0.09 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.556 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.723 ' O ' ' O ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -19.51 -42.13 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.968 -179.756 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.723 ' O ' ' O ' ' A' ' 10' ' ' ASN . 59.1 t80 20.15 131.11 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.909 0 N-CA-C 114.352 1.242 . . . . 0.0 114.352 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.588 ' C ' ' H ' ' A' ' 14' ' ' SER . 49.0 Cg_endo -67.62 102.35 0.72 Allowed 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.98 1.787 . . . . 0.0 112.624 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.517 ' O ' HG12 ' A' ' 13' ' ' VAL . 9.3 t -59.83 10.83 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.767 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.588 ' H ' ' C ' ' A' ' 12' ' ' PRO . 95.7 p -61.0 -5.58 1.46 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.599 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -166.78 127.85 1.65 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.016 0.436 . . . . 0.0 111.211 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 60.9 m -166.42 11.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.76 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.4 8.13 41.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.518 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.645 HD12 ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -159.51 136.98 9.86 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.21 0.528 . . . . 0.0 110.495 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.734 ' HB1' HD22 ' A' ' 23' ' ' ASN . . . -59.41 113.85 2.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.667 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.519 ' O ' ' C ' ' A' ' 21' ' ' GLN . 0.6 OUTLIER -175.83 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.844 179.441 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.519 ' C ' ' O ' ' A' ' 20' ' ' ASN . 72.0 tp60 -16.34 -74.37 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.92 0.763 . . . . 0.0 112.009 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.3 t -57.98 -49.25 77.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.734 HD22 ' HB1' ' A' ' 19' ' ' ALA . 44.8 t-20 -53.8 -69.56 0.12 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.144 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -38.96 32.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.562 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 29' ' ' ASP . 13.9 m-20 -55.45 -63.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.394 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.47 ' C ' ' H ' ' A' ' 28' ' ' LEU . 16.4 m -56.38 -38.95 72.15 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.57 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.196 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.647 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.3 tm? -163.24 -41.17 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.5 -0.48 . . . . 0.0 112.046 -179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.551 ' N ' ' O ' ' A' ' 25' ' ' ASP . 96.6 m-20 -68.26 -16.44 63.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 110.895 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -143.33 22.69 1.85 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.237 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 40.74 39.58 0.8 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.11 0.481 . . . . 0.0 111.131 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.37 -173.79 4.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.846 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.55 -40.74 9.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.229 0.537 . . . . 0.0 110.494 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.2 p -161.28 175.46 12.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.686 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -158.77 146.58 13.33 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 119.766 -1.207 . . . . 0.0 113.408 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -175.73 156.52 1.86 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.419 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 2.8 m -88.38 145.19 25.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.432 0.634 . . . . 0.0 112.553 -178.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -143.3 163.37 33.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.437 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -74.4 166.75 22.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.707 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.487 ' O ' ' C ' ' A' ' 41' ' ' GLU . 2.1 p30 -171.53 176.11 3.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.635 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.487 ' C ' ' O ' ' A' ' 40' ' ' ASP . 69.7 mm-40 15.42 -90.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.687 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 mtpt -99.68 63.8 1.25 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.734 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 40.41 50.18 2.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.374 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.28 121.25 42.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.553 179.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.77 86.65 7.35 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -99.36 144.36 28.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.226 -178.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.672 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -63.02 101.42 0.27 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.322 179.601 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mt -92.59 120.79 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.108 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 79.4 m -92.47 116.3 28.87 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.26 139.65 30.4 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.245 0.545 . . . . 0.0 111.281 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -109.42 -22.47 12.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.296 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.541 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -146.73 -59.44 0.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.769 0.318 . . . . 0.0 111.27 -179.439 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.541 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 8.7 tt0 90.25 -78.95 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.693 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.803 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.628 0 CA-C-O 120.757 0.313 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 t70 44.28 85.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.558 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm 60.49 -168.27 0.17 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.656 -179.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 19.4 m -156.24 -40.91 0.08 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.168 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.911 0.386 . . . . 0.0 111.513 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.55 ' C ' HG12 ' A' ' 7' ' ' VAL . 38.8 mttt -144.99 -164.46 1.93 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.301 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.55 HG12 ' C ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -167.69 157.16 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.432 . . . . 0.0 110.971 -179.42 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.604 ' CD1' ' O ' ' A' ' 10' ' ' ASN . 0.1 OUTLIER -85.86 107.78 17.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.991 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.49 4.88 0.33 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.212 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.604 ' O ' ' CD1' ' A' ' 8' ' ' TYR . 4.9 p30 172.96 123.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.987 0.423 . . . . 0.0 110.701 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.558 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER 178.66 156.79 0.6 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.439 -179.843 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.404 ' C ' ' O ' ' A' ' 11' ' ' TYR . 41.5 Cg_exo -30.11 84.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 123.31 2.674 . . . . 0.0 112.939 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.558 ' N ' ' O ' ' A' ' 11' ' ' TYR . 8.8 t -57.2 -36.74 52.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.546 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.33 -49.96 73.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.028 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -64.48 99.13 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.964 0.411 . . . . 0.0 110.388 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -172.08 110.64 0.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.286 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.495 ' O ' ' O ' ' A' ' 18' ' ' LEU . 75.7 mt-30 -137.36 52.85 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.651 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 20.8 mt 32.87 97.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.98 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 99.99 146.48 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 O-C-N 123.679 0.612 . . . . 0.0 111.422 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER 63.66 -79.3 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.671 179.359 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.53 39.99 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.586 ' N ' ' O ' ' A' ' 20' ' ' ASN . 9.9 t -179.58 -52.82 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.441 ' OD1' ' C ' ' A' ' 23' ' ' ASN . 10.8 t-20 -58.26 -54.24 49.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.146 178.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.523 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -57.39 -44.36 84.43 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.71 178.868 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 29' ' ' ASP . 0.1 OUTLIER -54.3 -58.64 6.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.521 179.729 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.55 ' C ' ' H ' ' A' ' 28' ' ' LEU . 85.1 m -55.11 -42.1 72.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 ttpp -62.28 12.26 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.697 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.55 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.2 tp -162.86 -44.2 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.631 -179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.641 ' N ' ' O ' ' A' ' 25' ' ' ASP . 94.1 m-20 -68.34 -17.41 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.056 0.455 . . . . 0.0 110.496 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.429 ' NZ ' ' O ' ' A' ' 7' ' ' VAL . 41.8 mttt -140.24 3.63 1.97 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.05 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.4 m170 53.23 35.9 21.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.965 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.657 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.46 -167.76 1.99 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.895 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -97.17 -44.75 6.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.023 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 84.0 p -157.69 -155.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.099 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 158.23 -171.53 35.15 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.448 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -175.98 162.61 2.6 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.933 0.397 . . . . 0.0 111.123 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 73.3 m -88.81 138.1 31.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.092 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -148.74 146.82 28.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.922 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.404 ' CE1' ' HG ' ' A' ' 45' ' ' LEU . 64.9 m-85 -86.36 160.64 19.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.853 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.6 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -93.33 -172.92 3.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.618 179.587 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -65.49 19.43 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.54 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.6 ' H ' ' C ' ' A' ' 40' ' ' ASP . 13.4 mtpp -140.93 -73.41 0.34 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.092 179.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.453 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 9.8 mtp85 153.45 57.67 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.644 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.47 ' O ' ' O ' ' A' ' 45' ' ' LEU . 0.7 OUTLIER -109.48 -0.25 18.95 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -178.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.47 ' O ' ' O ' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 57.3 136.77 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.752 0.311 . . . . 0.0 111.074 179.791 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -147.78 170.62 17.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.837 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.12 108.99 13.98 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.095 0.474 . . . . 0.0 111.515 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.9 mt -87.06 129.25 38.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.51 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.5 m -110.11 118.73 37.18 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.853 0.358 . . . . 0.0 111.187 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.657 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 4.8 t0 -96.55 152.95 18.15 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.794 179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 32' ' ' ALA . 13.8 m-85 -130.23 3.62 4.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.958 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.542 ' O ' ' O ' ' A' ' 53' ' ' GLU . 40.9 m -142.49 -110.83 0.13 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.423 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.542 ' O ' ' O ' ' A' ' 52' ' ' CYS . 6.6 mp0 20.75 107.06 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.503 0.502 . . . . 0.0 112.254 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.161 -0.924 . . . . 0.0 110.757 179.773 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.662 0 CA-C-O 120.836 0.35 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -76.26 -134.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.91 -179.912 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.43 ' C ' ' H ' ' A' ' 5' ' ' LYS . 14.3 mttp 66.21 126.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.061 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.16 15.34 0.33 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.729 179.923 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.457 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -141.11 113.99 8.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.435 179.828 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -98.54 125.36 43.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.189 -179.098 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.435 ' H ' HG13 ' A' ' 7' ' ' VAL . 0.7 OUTLIER -66.98 146.25 13.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.626 178.801 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.57 84.22 6.81 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.096 0.474 . . . . 0.0 109.8 179.246 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.585 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -67.08 113.91 5.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.687 179.839 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.585 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 23.3 t-20 117.17 -34.25 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 O-C-N 124.144 0.902 . . . . 0.0 110.698 179.835 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.577 ' O ' ' O ' ' A' ' 12' ' ' PRO . 38.2 t80 -41.25 140.32 1.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.241 -179.995 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.577 ' O ' ' O ' ' A' ' 11' ' ' TYR . 72.6 Cg_exo -48.22 -146.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 122.413 2.075 . . . . 0.0 113.408 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.56 HG22 ' C ' ' A' ' 12' ' ' PRO . 0.0 OUTLIER -169.99 74.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.449 -179.984 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.9 p -174.17 -64.93 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.842 -1.072 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.2 mmtt -67.72 97.28 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.256 179.103 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 0.8 OUTLIER -170.97 113.0 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.875 -179.44 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.493 ' CB ' ' O ' ' A' ' 16' ' ' CYS . 3.2 mm-40 156.72 -48.85 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.897 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' C ' ' A' ' 19' ' ' ALA . 10.9 mt -71.16 52.86 0.17 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.004 -179.542 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.544 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 3.78 84.97 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.974 0.797 . . . . 0.0 112.26 179.313 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.485 ' O ' ' C ' ' A' ' 21' ' ' GLN . 2.7 t-20 -164.18 -96.96 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.283 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.485 ' C ' ' O ' ' A' ' 20' ' ' ASN . 16.2 mm-40 -28.88 -76.8 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.489 -179.514 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.2 t -48.12 -64.95 0.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.904 0.383 . . . . 0.0 111.616 -179.735 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.504 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 2.8 t30 -47.63 -70.03 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.681 -179.681 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -50.61 -43.32 56.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.3 m-20 -51.77 -65.59 0.53 Allowed 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.509 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.41 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.5 m -52.8 -42.08 64.74 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.068 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.9 tttp -59.14 1.88 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.747 -179.698 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.41 ' H ' ' C ' ' A' ' 26' ' ' CYS . 2.0 tt -167.81 -44.8 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.732 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 14.3 m-20 -64.62 -2.19 2.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.944 0.402 . . . . 0.0 110.78 -179.342 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 37.7 mttm -144.75 8.58 1.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.33 179.338 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 53.48 36.03 22.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.768 179.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.593 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -88.11 -178.21 5.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 111.451 -179.691 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.485 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -93.68 -31.32 14.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.465 -179.935 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.1 p -176.72 -160.9 0.07 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.776 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.504 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . 146.68 173.41 17.89 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.249 -0.977 . . . . 0.0 112.775 179.615 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.408 ' HG3' ' H ' ' A' ' 37' ' ' CYS . 0.4 OUTLIER -176.49 179.01 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.844 0.354 . . . . 0.0 110.652 179.964 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.408 ' H ' ' HG3' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -87.44 103.29 15.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.531 179.712 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -95.22 152.49 18.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.417 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.635 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 20.0 m-85 -96.5 -166.8 1.47 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.287 179.269 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.591 ' C ' ' H ' ' A' ' 42' ' ' LYS . 14.1 p-10 -133.68 -174.06 3.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.815 0.34 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -65.69 28.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.858 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -145.6 -81.76 0.15 Allowed 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 179.268 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.08 39.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.441 179.142 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.635 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 2.7 m120 -90.17 -168.1 2.03 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.143 -179.315 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.49 HD21 ' CE1' ' A' ' 39' ' ' TYR . 7.7 mt -152.3 133.64 14.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.044 0.45 . . . . 0.0 111.619 -179.552 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -148.51 137.81 21.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.114 179.065 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.09 96.2 6.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.96 0.41 . . . . 0.0 111.217 -179.351 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.72 114.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.713 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 96.2 m -93.14 115.06 27.72 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.593 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 7.4 t70 -87.92 142.94 27.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.969 0.414 . . . . 0.0 111.584 -178.932 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -118.01 -27.26 6.18 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.485 -179.663 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.98 86.5 1.86 Allowed 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.984 0.421 . . . . 0.0 111.276 -179.358 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.525 ' O ' ' O ' ' A' ' 54' ' ' TYR . 0.0 OUTLIER -69.91 47.85 0.09 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.493 179.407 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.619 ' O ' ' CD1' ' A' ' 54' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.473 -179.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.538 0 CA-C-O 120.911 0.386 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.488 ' O ' ' C ' ' A' ' 3' ' ' LYS . 2.2 m-20 -79.7 -167.65 1.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.83 -179.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.488 ' C ' ' O ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER -20.68 137.29 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.717 0.635 . . . . 0.0 111.936 -179.93 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.473 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.7 m -175.26 -22.02 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.886 179.97 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm -138.0 129.08 27.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -148.89 126.47 11.68 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.815 0.341 . . . . 0.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -63.22 158.28 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.338 179.055 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.463 ' O ' ' C ' ' A' ' 9' ' ' GLU . 23.5 t80 -82.64 -15.75 50.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.055 0.455 . . . . 0.0 111.433 -179.368 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.463 ' C ' ' O ' ' A' ' 8' ' ' TYR . 1.9 pt-20 26.57 78.8 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.724 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.417 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 3.7 m-20 165.1 -41.23 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.204 179.513 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -52.16 108.86 1.18 Allowed Pre-proline 0 CA--C 1.535 0.401 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.593 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.615 ' O ' ' N ' ' A' ' 14' ' ' SER . 94.2 Cg_endo -81.57 70.41 7.32 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.179 1.919 . . . . 0.0 112.299 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.577 HG13 HD23 ' A' ' 45' ' ' LEU . 2.6 t 18.85 44.77 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 O-C-N 123.85 0.719 . . . . 0.0 112.142 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.615 ' N ' ' O ' ' A' ' 12' ' ' PRO . 3.7 p -67.42 -7.58 26.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.512 -179.929 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.494 ' O ' ' C ' ' A' ' 16' ' ' CYS . 30.0 tptt -172.35 -88.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.381 -179.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.5 OUTLIER 26.37 97.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.397 -179.787 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -144.17 1.76 1.11 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.157 -179.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.456 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 10.7 mt -164.24 -82.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.297 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 176.58 109.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.794 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -179.13 -82.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.336 -179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.452 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 3.3 tp60 -46.45 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.224 -179.414 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.28 -40.18 85.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.523 -179.57 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -53.23 -65.94 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.41 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.563 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -52.24 -42.2 63.42 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.033 178.882 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.643 ' O ' ' N ' ' A' ' 29' ' ' ASP . 53.9 m-20 -50.79 -60.73 2.75 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 179.815 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 28' ' ' LEU . 57.0 m -54.86 -49.9 70.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 178.379 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 17.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.869 179.503 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.517 ' C ' HD13 ' A' ' 28' ' ' LEU . 3.5 tm? -165.47 -54.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.018 -0.673 . . . . 0.0 112.262 -179.395 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.643 ' N ' ' O ' ' A' ' 25' ' ' ASP . 11.0 m-20 -67.77 -11.73 59.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.743 0.306 . . . . 0.0 111.16 -179.507 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 31' ' ' HIS . 24.9 mttm -139.14 27.21 2.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.849 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.597 ' N ' ' CD2' ' A' ' 31' ' ' HIS . 0.0 OUTLIER 34.71 38.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.287 0.565 . . . . 0.0 110.328 -179.995 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.571 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -83.7 176.75 8.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.814 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.437 ' H ' ' HA ' ' A' ' 51' ' ' TYR . 31.3 ttm180 -92.81 -27.62 17.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 -179.967 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.8 p 177.96 -165.08 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.497 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.77 -176.88 47.58 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.476 -179.982 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -175.49 157.57 2.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.882 0.372 . . . . 0.0 110.962 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -90.7 104.38 16.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.603 -179.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -96.19 171.54 8.54 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.53 ' O ' ' O ' ' A' ' 40' ' ' ASP . 3.5 m-85 -99.11 -8.84 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.626 0.251 . . . . 0.0 111.039 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.53 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.4 OUTLIER 50.43 161.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.164 0.507 . . . . 0.0 111.276 179.578 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -63.98 8.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.094 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -105.35 -23.72 12.8 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-O 120.9 0.381 . . . . 0.0 110.578 -179.982 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 66.29 52.2 1.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.665 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -139.24 12.22 2.59 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.825 0.345 . . . . 0.0 111.492 -179.641 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.577 HD23 HG13 ' A' ' 13' ' ' VAL . 4.7 tp 64.79 122.36 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.191 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -143.19 155.05 44.45 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.832 179.228 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 98.7 m -98.47 113.13 25.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.981 0.42 . . . . 0.0 112.016 -179.136 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -91.8 117.01 34.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.569 179.607 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.9 m -94.95 112.15 23.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.571 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 3.6 t70 -94.85 154.21 17.35 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.971 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.437 ' HA ' ' H ' ' A' ' 33' ' ' ARG . 66.7 m-85 -131.04 -22.34 2.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.438 -179.017 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.543 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -139.13 -64.64 0.5 Allowed 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.724 0.297 . . . . 0.0 110.948 -179.439 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.543 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 9.4 tt0 88.17 -9.97 0.51 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.109 179.921 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.464 ' CD1' ' O ' ' A' ' 53' ' ' GLU . 46.3 m-85 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.978 179.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.613 0 CA-C-O 120.8 0.333 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.409 ' CG ' ' O ' ' A' ' 2' ' ' ASP . 14.5 p-10 -89.96 70.17 7.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.716 179.99 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.29 93.1 4.35 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.044 0.45 . . . . 0.0 111.213 -179.797 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.64 11.89 1.89 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.671 179.426 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -97.23 121.45 39.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.889 179.859 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.73 126.1 24.97 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.064 0.459 . . . . 0.0 111.144 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 8' ' ' TYR . 1.5 m -62.36 149.52 9.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.014 179.846 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.484 ' O ' ' O ' ' A' ' 7' ' ' VAL . 0.3 OUTLIER -51.01 -103.44 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.7 179.19 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.454 ' H ' ' HB3' ' A' ' 8' ' ' TYR . 0.7 OUTLIER 178.13 -14.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.378 -0.201 . . . . 0.0 111.484 179.445 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -178.01 21.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.326 . . . . 0.0 110.996 -179.308 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.491 ' OH ' ' OE1' ' A' ' 21' ' ' GLN . 49.8 t80 -56.01 113.54 5.96 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.592 179.654 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.02 99.23 0.03 OUTLIER 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.077 1.851 . . . . 0.0 112.256 179.926 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -53.7 92.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.39 179.759 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.556 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 0.6 OUTLIER -175.46 128.5 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.797 -179.702 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.556 ' CB ' ' O ' ' A' ' 14' ' ' SER . 2.9 tptt 92.62 -13.35 0.17 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.631 -179.82 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m -66.56 70.61 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.728 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' A' ' 15' ' ' LYS . 10.3 mp0 -114.43 -15.62 12.05 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.376 -179.734 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.587 ' N ' HD12 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -162.11 176.27 10.87 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.93 0.395 . . . . 0.0 110.349 -179.843 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 18' ' ' LEU . . . -56.7 -149.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.639 -179.837 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 61.55 -79.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.262 -179.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.491 ' OE1' ' OH ' ' A' ' 11' ' ' TYR . 7.8 tp-100 -41.18 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.153 -179.645 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 t -59.36 -41.89 90.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.22 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.21 -74.16 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.009 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.539 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -49.33 -40.12 34.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.529 179.92 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.56 ' O ' ' N ' ' A' ' 29' ' ' ASP . 7.7 m-20 -55.64 -65.05 0.66 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.137 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.456 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.9 m -56.33 -35.93 68.17 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.906 -179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.2 ttpp -59.86 2.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.93 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.456 ' H ' ' C ' ' A' ' 26' ' ' CYS . 13.2 tp -165.14 -36.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.56 ' N ' ' O ' ' A' ' 25' ' ' ASP . 6.0 m-20 -67.86 -14.17 62.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -141.38 16.9 2.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.756 179.677 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.4 m80 53.2 29.11 7.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.62 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.46 -175.61 5.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.634 -179.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -98.41 -50.34 4.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 -179.82 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 0.0 OUTLIER -141.43 -173.58 3.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.323 179.595 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.457 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . -168.21 166.38 39.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.063 -1.065 . . . . 0.0 113.363 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -177.2 146.68 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.05 138.43 31.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.993 0.425 . . . . 0.0 111.527 -179.453 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -146.19 158.1 43.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.644 179.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.563 ' CE2' ' CD2' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -81.93 155.26 25.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.839 179.77 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.55 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 4.6 p-10 -161.5 58.62 0.28 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.832 0.348 . . . . 0.0 111.688 -179.885 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.55 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 19.1 tp10 93.34 -16.86 0.12 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.47 -0.787 . . . . 0.0 111.579 178.685 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.61 -7.53 34.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.234 -179.221 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? 40.11 39.87 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.915 0.388 . . . . 0.0 110.236 -179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -143.64 5.58 1.4 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.563 ' CD2' ' CE2' ' A' ' 39' ' ' TYR . 1.0 OUTLIER 71.65 152.67 0.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.192 179.441 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -149.09 137.4 20.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.163 179.483 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 98.83 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 43.0 mm -89.82 113.29 25.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 178.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.2 m -92.36 129.84 38.2 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.079 0.466 . . . . 0.0 111.231 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -96.13 125.17 40.47 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.689 179.575 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -98.92 -27.44 13.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.752 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.8 m -101.03 -107.81 0.23 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.184 0.516 . . . . 0.0 110.867 179.741 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.551 ' CG ' ' H ' ' A' ' 54' ' ' TYR . 4.1 tp10 -168.3 -137.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.176 179.988 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.551 ' H ' ' CG ' ' A' ' 53' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.189 -0.91 . . . . 0.0 110.137 179.676 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.58 0 CA-C-O 120.829 0.347 . . . . 0.0 111.347 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.43 ' O ' ' C ' ' A' ' 3' ' ' LYS . 53.8 t0 -166.64 -61.03 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.746 179.838 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.575 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 30.5 mmtt -37.13 122.46 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.59 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.575 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.3 m 158.66 -3.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.035 -179.424 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -87.7 143.29 27.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.312 0.577 . . . . 0.0 112.037 -178.782 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -147.88 122.16 9.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.922 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.74 149.89 5.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.477 ' N ' ' O ' ' A' ' 47' ' ' CYS . 0.3 OUTLIER -105.86 76.65 1.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.875 -1.057 . . . . 0.0 108.305 177.719 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 11' ' ' TYR . 1.6 pt-20 -47.63 -94.0 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.689 -179.269 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -47.18 92.76 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.377 178.877 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.496 ' N ' ' O ' ' A' ' 9' ' ' GLU . 67.1 t80 -177.8 107.29 0.22 Allowed Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.05 -179.099 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.589 ' O ' ' N ' ' A' ' 14' ' ' SER . 88.3 Cg_exo -46.57 124.36 8.05 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.351 2.034 . . . . 0.0 112.276 179.925 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.662 ' O ' HG12 ' A' ' 13' ' ' VAL . 40.8 t -60.57 45.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.938 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.589 ' N ' ' O ' ' A' ' 12' ' ' PRO . 78.5 p -63.3 -125.86 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.476 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -68.64 151.91 46.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.335 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.464 ' C ' ' H ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -173.27 -32.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.205 179.842 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -74.19 38.93 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.608 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 16' ' ' CYS . 27.4 mt -161.91 -102.58 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.828 -179.639 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 21' ' ' GLN . . . -179.62 -153.69 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.415 -179.443 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER 59.74 -82.49 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.417 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.479 HE21 ' CA ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -33.82 -76.46 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.475 -179.979 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.91 -52.34 65.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.244 0.545 . . . . 0.0 110.661 179.242 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -53.65 -78.25 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.32 -179.623 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -44.87 -48.98 11.15 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.832 -179.361 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.451 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 5.0 m-20 -52.88 -65.77 0.5 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 121.03 -0.268 . . . . 0.0 111.442 -179.319 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.475 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -57.34 -29.9 64.37 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.52 -179.854 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.84 1.54 0.14 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.071 179.131 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.475 ' H ' ' C ' ' A' ' 26' ' ' CYS . 23.6 tp -162.44 -31.73 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.391 -179.575 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -68.63 -17.56 64.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.202 0.525 . . . . 0.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -141.93 -1.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.54 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.3 m80 63.73 42.15 6.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.791 -179.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.496 ' HB2' ' CE2' ' A' ' 51' ' ' TYR . . . -89.03 -173.62 4.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 8.1 ttp180 -98.99 -56.5 2.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.999 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 48.4 p -167.55 135.34 2.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.038 -179.931 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -123.28 -165.13 12.25 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.42 -0.895 . . . . 0.0 114.983 -178.124 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -176.14 -145.77 0.02 OUTLIER 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.16 -1.02 . . . . 0.0 109.118 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.17 137.55 20.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.924 0.393 . . . . 0.0 111.655 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.537 ' CD2' ' CD1' ' A' ' 48' ' ' ILE . 19.6 m-85 -142.21 157.07 45.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.304 178.968 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.532 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 17.2 m-85 -72.08 169.3 16.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.433 -179.582 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -162.9 -158.94 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.436 -179.488 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -62.88 -11.26 17.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.828 -179.36 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.591 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -94.62 10.15 35.96 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -179.084 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 52.33 2.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.983 0.421 . . . . 0.0 111.144 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.804 ' C ' HD23 ' A' ' 45' ' ' LEU . 4.0 m120 -100.88 -136.04 0.31 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.619 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.804 HD23 ' C ' ' A' ' 44' ' ' ASN . 0.2 OUTLIER -152.39 118.47 5.5 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.317 0.579 . . . . 0.0 111.183 179.053 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -97.26 152.03 19.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.548 -179.601 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.477 ' O ' ' N ' ' A' ' 8' ' ' TYR . 0.1 OUTLIER -78.18 113.38 16.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.665 179.617 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.537 ' CD1' ' CD2' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -101.31 113.0 36.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.739 -179.693 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.3 m -99.11 134.56 41.78 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.338 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.2 t70 -95.2 115.81 27.92 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.849 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.496 ' CE2' ' HB2' ' A' ' 32' ' ' ALA . 96.8 m-85 -103.43 57.0 0.74 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.648 -179.224 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.84 21.6 9.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.338 . . . . 0.0 111.158 -179.531 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -77.11 4.04 11.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.149 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.741 179.9 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.53 0 CA-C-O 120.822 0.344 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -177.86 -159.66 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.808 -179.807 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.1 mttt 71.15 150.98 0.1 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.948 0.404 . . . . 0.0 111.294 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m 51.34 48.59 22.7 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.24 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.05 155.99 43.16 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.791 179.275 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -151.01 110.24 3.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.017 0.437 . . . . 0.0 111.198 -179.698 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.411 HG13 ' H ' ' A' ' 7' ' ' VAL . 1.6 m -66.45 144.84 14.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.239 179.876 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.553 ' O ' ' CG ' ' A' ' 9' ' ' GLU . 1.9 t80 -63.13 -75.52 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.484 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.58 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 1.3 pp20? 104.26 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 O-C-N 124.649 1.218 . . . . 0.0 112.074 178.466 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.58 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 10.4 t-20 107.89 -12.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.346 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -52.92 113.49 4.65 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.847 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -42.73 112.48 0.27 Allowed 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.014 1.81 . . . . 0.0 112.101 179.812 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.507 ' O ' ' C ' ' A' ' 14' ' ' SER . 69.4 t -52.7 -70.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.507 ' C ' ' O ' ' A' ' 13' ' ' VAL . 20.6 p 21.28 -95.04 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.669 179.974 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -69.82 108.95 4.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.477 179.667 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -173.27 57.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -141.54 22.46 2.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.82 179.943 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -167.81 125.87 1.21 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.53 179.947 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.24 99.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.627 -179.785 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.485 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.5 OUTLIER -175.98 -68.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.603 179.293 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.435 HE21 ' C ' ' A' ' 21' ' ' GLN . 2.8 tp60 -47.99 -74.56 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.811 179.873 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.8 t -58.52 -40.52 83.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.181 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -53.49 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 -179.674 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.554 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -51.37 -45.39 62.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.344 179.998 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -64.48 0.8 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.835 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.446 ' C ' ' H ' ' A' ' 28' ' ' LEU . 72.2 m -54.45 -33.61 59.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -61.89 3.37 0.16 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.591 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.446 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.9 OUTLIER -164.35 -27.26 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.531 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -70.02 -29.67 66.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.789 0.328 . . . . 0.0 110.993 -179.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 31' ' ' HIS . 1.8 mtmp? -141.66 40.88 1.71 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.957 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.448 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.4 m80 31.73 44.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.363 179.864 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.12 179.27 6.17 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.92 0.39 . . . . 0.0 111.244 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.416 ' HG3' HH11 ' A' ' 33' ' ' ARG . 34.9 ttm-85 -96.15 -20.31 18.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.984 179.406 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.0 p 177.84 -176.24 0.18 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.241 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.6 167.87 36.56 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.796 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -177.24 157.21 1.32 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.805 0.336 . . . . 0.0 110.44 179.766 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -89.53 106.16 18.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.43 -179.369 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.454 ' HB2' HD12 ' A' ' 48' ' ' ILE . 30.0 m-85 -107.96 151.28 26.01 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.897 179.811 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.401 ' CE2' HD22 ' A' ' 45' ' ' LEU . 8.1 m-85 -81.13 177.17 9.2 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.935 0.398 . . . . 0.0 111.592 -179.76 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.641 ' O ' ' N ' ' A' ' 42' ' ' LYS . 1.4 p30 -167.94 95.24 0.42 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.01 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' A' ' 40' ' ' ASP . 14.4 tt0 27.02 32.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.263 -179.908 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.641 ' N ' ' O ' ' A' ' 40' ' ' ASP . 16.9 mtpp -147.19 0.76 0.72 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.24 179.815 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 61.89 0.98 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.022 0.439 . . . . 0.0 110.283 -179.165 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.59 ' ND2' ' O ' ' A' ' 42' ' ' LYS . 1.9 m120 -92.94 133.35 36.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.152 179.456 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.421 ' H ' ' HG ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -86.44 117.49 25.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.569 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -100.63 141.45 33.48 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.086 178.653 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.88 94.26 1.41 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.96 0.409 . . . . 0.0 111.42 -179.682 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.454 HD12 ' HB2' ' A' ' 38' ' ' PHE . 5.8 mt -90.13 120.32 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.562 179.58 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 73.4 m -92.75 114.97 27.68 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 178.927 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.69 135.49 33.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.978 0.418 . . . . 0.0 111.246 -179.254 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.408 ' OH ' ' O ' ' A' ' 30' ' ' LYS . 10.7 m-85 -109.66 -21.84 12.23 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.047 -178.891 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.517 ' O ' ' N ' ' A' ' 54' ' ' TYR . 2.4 m -140.27 -34.58 0.53 Allowed 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.828 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.59 ' O ' ' CD2' ' A' ' 54' ' ' TYR . 2.5 pt-20 34.44 -94.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.915 0.388 . . . . 0.0 110.281 -178.848 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.59 ' CD2' ' O ' ' A' ' 53' ' ' GLU . 7.9 m-85 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.68 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 CA-C-O 120.79 0.329 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -132.74 -122.31 0.19 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.593 179.962 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.448 ' C ' ' H ' ' A' ' 5' ' ' LYS . 18.4 mtmt 60.34 80.39 0.21 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.436 179.828 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER 67.01 -34.62 0.23 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.245 179.076 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.448 ' H ' ' C ' ' A' ' 3' ' ' LYS . 17.9 pttm -96.48 132.86 41.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.16 0.505 . . . . 0.0 111.906 -179.227 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -146.83 134.79 21.41 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.76 179.908 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.478 ' O ' ' OE2' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -65.2 154.75 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.441 -179.919 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.475 ' OH ' ' OD2' ' A' ' 29' ' ' ASP . 1.0 OUTLIER -92.68 85.06 5.13 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.397 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.544 ' O ' ' C ' ' A' ' 10' ' ' ASN . 1.0 OUTLIER -58.1 171.6 0.52 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.561 -178.917 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.544 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER 16.02 101.09 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.599 0.562 . . . . 0.0 111.568 -179.389 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.62 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.5 OUTLIER 175.91 141.13 0.21 Allowed Pre-proline 0 CA--C 1.534 0.328 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.037 -178.92 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -34.03 80.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.948 2.432 . . . . 0.0 113.07 -179.604 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.62 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.8 p -60.23 -27.06 38.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.448 179.841 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.2 p -62.42 -45.93 90.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.329 -179.39 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.42 82.9 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.04 0.448 . . . . 0.0 110.614 -179.782 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -173.64 95.08 0.1 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 179.867 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.43 -34.15 3.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.933 179.552 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.458 HD23 ' HA ' ' A' ' 18' ' ' LEU . 7.0 mt -164.69 -175.21 3.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.304 179.852 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.559 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -53.82 177.1 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.376 -179.963 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.559 ' CB ' ' O ' ' A' ' 19' ' ' ALA . 0.2 OUTLIER 96.93 -85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.778 179.697 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -50.82 -70.04 0.1 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.699 0.285 . . . . 0.0 111.66 -179.157 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.558 ' SG ' ' O ' ' A' ' 36' ' ' GLU . 6.3 t -53.93 -45.15 71.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.17 -179.481 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -55.47 -66.9 0.34 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.061 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -50.55 -47.44 57.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.817 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.454 ' O ' ' C ' ' A' ' 28' ' ' LEU . 2.2 m-20 -52.67 -51.11 61.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 179.555 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.643 ' C ' ' H ' ' A' ' 28' ' ' LEU . 87.4 m -57.88 -40.79 81.07 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.585 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -57.46 -0.45 0.06 Allowed 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 177.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.711 ' O ' ' N ' ' A' ' 30' ' ' LYS . 10.1 tp -162.96 -139.39 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.202 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.475 ' OD2' ' OH ' ' A' ' 8' ' ' TYR . 3.7 m-20 65.24 -50.39 0.36 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 -177.16 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.711 ' N ' ' O ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -126.06 -85.97 0.62 Allowed 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.389 175.772 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.578 ' CD2' ' O ' ' A' ' 30' ' ' LYS . 1.3 p80 169.13 54.16 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.41 178.053 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -89.05 179.73 6.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.799 179.468 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.28 -33.46 12.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.184 0.516 . . . . 0.0 110.482 -179.991 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.421 ' OG ' ' CD ' ' A' ' 53' ' ' GLU . 13.6 p -166.42 -162.57 0.53 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.569 -0.742 . . . . 0.0 109.811 179.833 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 177.72 -168.58 40.16 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 119.693 -1.242 . . . . 0.0 113.471 179.847 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.558 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.7 OUTLIER -177.06 -158.54 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -179.921 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.32 144.79 26.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 111.508 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.449 ' O ' ' N ' ' A' ' 46' ' ' GLN . 57.5 m-85 -144.77 159.97 42.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.198 -179.705 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.596 ' CG ' ' O ' ' A' ' 44' ' ' ASN . 3.1 m-85 -84.44 173.97 10.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.683 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -153.85 -171.4 3.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.929 0.395 . . . . 0.0 111.133 -179.769 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -12.93 20.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.533 -179.869 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' ' C ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -95.04 25.88 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.887 -179.912 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER 29.55 55.2 0.13 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.192 179.566 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.596 ' O ' ' CG ' ' A' ' 39' ' ' TYR . 75.6 m-20 -141.8 -125.27 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.704 179.701 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.543 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -148.78 162.43 39.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.318 . . . . 0.0 110.592 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 38' ' ' PHE . 20.1 mt-30 -148.3 114.57 5.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.704 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -68.52 102.95 1.56 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.453 -179.513 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.6 mm -89.09 114.89 27.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.06 179.304 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.8 m -98.0 119.21 36.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.988 0.423 . . . . 0.0 110.894 179.801 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.13 130.02 44.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.176 -179.923 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -95.56 -21.67 18.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.963 -179.613 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.495 ' O ' ' N ' ' A' ' 54' ' ' TYR . 16.6 m -97.4 -78.65 0.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.947 -179.752 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.421 ' CD ' ' OG ' ' A' ' 34' ' ' SER . 34.7 tt0 59.0 -77.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.866 -179.806 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 52' ' ' CYS . 44.0 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.799 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 120.824 0.345 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.474 ' O ' ' O ' ' A' ' 3' ' ' LYS . 3.0 p-10 -130.2 -169.76 2.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.89 -179.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.474 ' O ' ' O ' ' A' ' 2' ' ' ASP . 32.8 mttp -51.71 -107.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.648 179.842 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m -172.85 -1.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.934 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.34 148.73 40.17 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 120.915 0.388 . . . . 0.0 110.355 179.71 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -150.36 125.56 10.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.881 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -65.58 150.13 10.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-O 120.837 0.351 . . . . 0.0 111.063 179.768 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.503 ' O ' ' O ' ' A' ' 9' ' ' GLU . 30.2 t80 -100.19 -10.92 20.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.214 0.531 . . . . 0.0 110.888 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.563 ' O ' ' C ' ' A' ' 10' ' ' ASN . 2.0 pm0 34.31 -158.04 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.64 -179.576 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.563 ' C ' ' O ' ' A' ' 9' ' ' GLU . 37.2 t-20 2.42 102.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.671 0.607 . . . . 0.0 111.863 -179.719 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.3 OUTLIER 179.97 141.13 0.32 Allowed Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.561 -179.197 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -40.03 90.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.232 1.955 . . . . 0.0 112.409 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.639 ' O ' ' N ' ' A' ' 15' ' ' LYS . 54.7 t -52.87 -90.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.361 179.863 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.496 ' C ' ' O ' ' A' ' 13' ' ' VAL . 60.7 p 9.96 -70.21 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 O-C-N 123.864 0.728 . . . . 0.0 112.866 179.206 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.639 ' N ' ' O ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -60.28 89.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.997 -179.546 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 116.92 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.356 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -114.15 -54.16 2.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.569 179.766 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.447 ' O ' ' HB2' ' A' ' 19' ' ' ALA . 1.4 mt -174.2 -20.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.918 179.467 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.447 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 178.7 104.24 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.631 -179.693 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.565 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -175.64 -97.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.163 179.709 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.439 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 30.7 mm100 -50.71 -52.05 43.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.802 -179.772 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.65 -59.29 5.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 179.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.528 HD22 ' C ' ' A' ' 23' ' ' ASN . 0.1 OUTLIER -49.8 -63.68 1.04 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.57 -179.833 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -48.7 69.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.312 179.564 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 29' ' ' ASP . 23.7 m-20 -49.24 -65.14 0.62 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.5 179.816 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 28' ' ' LEU . 62.7 m -49.93 -41.99 47.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.326 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 ttpt -61.0 10.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.659 179.169 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 26' ' ' CYS . 11.3 tp -163.14 -30.1 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.684 0.278 . . . . 0.0 111.711 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -70.0 -61.35 1.81 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.345 179.776 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.84 19.17 14.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.256 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 53.2 32.94 14.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 -179.31 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.601 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -84.28 -177.35 6.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.784 -179.431 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.0 -42.06 8.46 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.767 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.3 p -154.85 -156.44 0.67 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 -179.842 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 171.2 -175.91 44.67 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.569 -179.872 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -177.78 155.82 1.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 -179.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.459 ' SG ' ' O ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -87.43 155.48 20.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.876 0.369 . . . . 0.0 110.899 179.99 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -146.65 121.13 9.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.949 -179.808 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.662 ' CE1' HD21 ' A' ' 45' ' ' LEU . 34.8 m-85 -70.87 -93.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.245 179.555 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.54 ' O ' ' CB ' ' A' ' 41' ' ' GLU . 0.0 OUTLIER 53.94 147.65 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.499 0.666 . . . . 0.0 111.694 179.409 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.54 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 2.6 tt0 89.62 -79.22 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.728 178.299 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.63 73.65 1.19 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.201 -178.792 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.58 38.78 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.296 179.314 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.634 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 54.1 m-80 -92.77 -163.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.132 179.76 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.662 HD21 ' CE1' ' A' ' 39' ' ' TYR . 9.2 mt -155.23 98.22 1.98 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.786 0.327 . . . . 0.0 111.266 179.984 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.459 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 78.1 mt-30 -94.79 170.51 9.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.018 179.148 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.8 109.46 15.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.042 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.7 mm -92.68 121.62 43.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.55 179.367 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 90.8 m -99.93 122.58 43.07 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.647 0.26 . . . . 0.0 110.63 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.601 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.1 OUTLIER -93.85 141.63 28.29 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.91 0.386 . . . . 0.0 110.63 -179.996 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -114.75 -12.83 12.1 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.907 -179.102 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -137.21 4.94 2.73 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.624 0.25 . . . . 0.0 111.374 -179.388 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.454 ' O ' ' C ' ' A' ' 54' ' ' TYR . 4.9 tt0 40.38 66.55 0.6 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.056 0.455 . . . . 0.0 110.653 179.913 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.454 ' C ' ' O ' ' A' ' 53' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.691 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 120.845 0.355 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -46.93 -57.45 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.148 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 mttm -91.25 153.28 20.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.47 -179.586 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER 173.4 -75.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.962 179.388 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -95.42 135.92 36.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.32 113.83 7.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.998 0.427 . . . . 0.0 111.331 -179.434 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.445 HG13 ' H ' ' A' ' 7' ' ' VAL . 0.8 OUTLIER -65.3 135.93 27.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.458 179.228 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.531 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -64.82 106.61 1.25 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.902 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.457 ' O ' ' CG ' ' A' ' 10' ' ' ASN . 8.5 mt-10 -63.06 43.16 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.324 -178.785 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 8' ' ' TYR . 1.3 m120 172.42 -97.75 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.561 179.878 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.519 ' C ' ' O ' ' A' ' 10' ' ' ASN . 8.2 t80 8.52 76.37 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.423 0 O-C-N 123.733 0.645 . . . . 0.0 112.63 -179.928 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.542 ' O ' ' C ' ' A' ' 13' ' ' VAL . 25.6 Cg_exo -62.66 109.66 0.94 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.985 2.457 . . . . 0.0 112.026 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.555 ' O ' ' CB ' ' A' ' 14' ' ' SER . 21.6 t 8.75 -108.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 O-C-N 123.845 0.716 . . . . 0.0 112.039 179.946 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 13' ' ' VAL . 5.1 p 91.33 -45.15 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.754 0.312 . . . . 0.0 111.457 179.124 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -172.56 74.94 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.977 0.418 . . . . 0.0 110.874 -178.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -66.44 -59.9 3.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.893 -179.689 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.596 ' O ' ' N ' ' A' ' 19' ' ' ALA . 0.9 OUTLIER 61.5 10.81 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.738 179.207 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.482 HD12 ' N ' ' A' ' 18' ' ' LEU . 6.5 mp 30.79 30.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.596 ' N ' ' O ' ' A' ' 17' ' ' GLN . . . 175.99 35.8 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.732 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER -166.47 -141.29 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.518 179.537 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.548 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER 2.62 -69.37 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 124.008 0.817 . . . . 0.0 111.981 179.721 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.586 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.1 t -58.94 -65.71 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.023 179.57 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' ASN . 44.4 t-20 -51.29 -54.81 22.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.958 179.901 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -54.33 -44.63 72.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.137 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 78.6 m-20 -57.28 -64.79 0.77 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.219 179.85 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.479 ' C ' ' H ' ' A' ' 28' ' ' LEU . 58.1 m -52.78 -51.46 60.58 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.742 179.846 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -59.72 10.55 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.816 -179.799 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.479 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.82 -52.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 119.998 -0.681 . . . . 0.0 112.72 -179.495 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.5 OUTLIER -66.72 -7.57 21.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.578 0.228 . . . . 0.0 111.474 -179.12 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.409 ' NZ ' ' SG ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -141.81 24.84 2.01 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.952 0.406 . . . . 0.0 110.378 179.448 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.7 m80 38.46 38.91 0.27 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.037 179.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.16 -176.35 5.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.827 179.849 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -95.85 -45.27 7.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.384 179.825 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.474 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 2.7 p -168.93 130.96 1.24 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.92 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -101.98 174.88 24.71 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.33 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -174.92 138.31 0.46 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.982 0.42 . . . . 0.0 110.583 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.2 m -89.48 113.12 24.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.416 -179.453 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.623 ' CD1' HD12 ' A' ' 48' ' ' ILE . 18.7 m-85 -97.98 141.54 30.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.423 179.297 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.494 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 9.5 m-85 -83.26 -169.67 2.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.936 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.562 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 2.9 p-10 -173.59 156.03 2.87 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.346 0.593 . . . . 0.0 112.04 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.464 ' C ' ' O ' ' A' ' 40' ' ' ASP . 21.9 mt-10 16.92 -82.27 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.103 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 40' ' ' ASP . 3.9 mptt -91.64 60.87 4.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.232 0.539 . . . . 0.0 110.943 -178.917 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.467 ' C ' ' O ' ' A' ' 42' ' ' LYS . 28.3 mmt180 29.04 60.44 0.14 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.584 179.82 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.689 ' C ' HD12 ' A' ' 45' ' ' LEU . 0.6 OUTLIER -95.39 -154.53 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.792 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.689 HD12 ' C ' ' A' ' 44' ' ' ASN . 5.7 mp -155.23 140.73 17.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.844 0.354 . . . . 0.0 110.995 179.545 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -143.05 131.81 22.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.252 179.834 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -74.66 101.73 4.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.358 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.623 HD12 ' CD1' ' A' ' 38' ' ' PHE . 15.7 mt -95.84 114.31 32.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.474 178.194 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.409 ' SG ' ' NZ ' ' A' ' 30' ' ' LYS . 91.7 m -94.73 118.8 32.32 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.301 179.364 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.474 ' CB ' ' O ' ' A' ' 34' ' ' SER . 7.1 t0 -94.45 118.3 31.43 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.452 0.644 . . . . 0.0 111.212 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -99.21 -89.65 0.31 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.029 179.6 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.4 m 62.45 26.22 15.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.032 179.53 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -125.07 -0.12 7.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.473 179.569 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.196 -0.906 . . . . 0.0 110.896 179.819 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.554 0 CA-C-O 120.897 0.38 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -69.41 50.08 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.952 179.953 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.9 mmtt -84.7 125.3 32.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.844 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.01 -12.22 60.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.752 179.934 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.92 97.01 3.02 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.411 -179.841 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.4 mttt -93.72 107.22 19.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.897 0.38 . . . . 0.0 111.36 -179.894 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.42 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.1 m -66.55 130.7 32.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.719 179.873 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.546 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -74.27 58.58 0.73 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.069 0.461 . . . . 0.0 110.442 179.504 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.567 ' O ' ' N ' ' A' ' 11' ' ' TYR . 7.1 mt-10 26.2 -153.61 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.442 179.853 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -60.16 56.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.611 -179.61 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.567 ' N ' ' O ' ' A' ' 9' ' ' GLU . 42.8 t80 -50.69 140.97 18.41 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.414 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.409 ' HD2' ' CG ' ' A' ' 11' ' ' TYR . 17.0 Cg_endo -57.29 92.48 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 -179.68 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.0 t -53.88 105.88 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.185 -179.622 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.9 p -176.33 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.05 179.98 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.571 ' O ' ' SG ' ' A' ' 16' ' ' CYS . 16.2 mmmt -66.02 136.39 55.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.108 179.169 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.571 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 14.5 m -170.11 -64.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.616 0.246 . . . . 0.0 111.492 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.477 ' C ' ' O ' ' A' ' 16' ' ' CYS . 1.7 mm-40 -28.14 -38.8 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.408 -179.478 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 16' ' ' CYS . 1.1 mp -70.65 -120.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.19 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.45 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -179.65 -20.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.248 0.547 . . . . 0.0 111.631 -179.736 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.479 ' O ' ' C ' ' A' ' 21' ' ' GLN . 1.2 t-20 -47.62 -106.38 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.847 -178.93 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.479 ' C ' ' O ' ' A' ' 20' ' ' ASN . 13.7 mm-40 -25.26 -60.22 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.309 -179.131 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 2.3 t -54.04 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.937 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 2.5 t-20 -48.73 -54.83 13.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.901 -179.324 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -52.29 -55.83 18.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.648 179.907 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.619 ' O ' ' N ' ' A' ' 29' ' ' ASP . 96.8 m-20 -50.74 -55.16 17.99 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.262 -179.619 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.491 ' C ' ' H ' ' A' ' 28' ' ' LEU . 64.0 m -54.85 -45.9 74.61 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.938 -179.954 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -61.44 11.84 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.531 -0.758 . . . . 0.0 112.223 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 26' ' ' CYS . 6.7 tt -165.02 -47.33 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.294 -0.562 . . . . 0.0 112.261 -179.469 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.619 ' N ' ' O ' ' A' ' 25' ' ' ASP . 92.4 m-20 -66.7 -11.27 53.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.133 0.492 . . . . 0.0 110.169 179.789 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.427 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 36.0 mmtm -141.72 5.37 1.77 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.038 179.427 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.427 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.7 OUTLIER 41.17 46.05 2.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.737 -179.866 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.32 -173.7 4.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.917 179.759 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -93.12 -23.59 18.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.291 0.567 . . . . 0.0 109.698 179.541 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -177.64 -168.44 0.18 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.993 179.702 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.468 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . 166.95 170.26 31.6 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.929 179.943 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -179.31 -179.97 0.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.732 0.301 . . . . 0.0 110.259 179.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 39.1 m -88.61 88.82 7.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.266 179.391 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.524 ' HB2' HD12 ' A' ' 48' ' ' ILE . 42.9 m-85 -91.72 159.06 16.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.834 -179.734 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.565 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 5.0 m-85 -83.77 166.26 18.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.008 179.926 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.538 ' CG ' HE22 ' A' ' 46' ' ' GLN . 6.3 p-10 -129.19 -173.15 2.91 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.047 -179.532 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.52 2.06 0.19 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.29 -179.656 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -95.61 -63.89 1.11 Allowed 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.391 179.777 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.557 ' HB2' ' O ' ' A' ' 42' ' ' LYS . 0.8 OUTLIER 139.78 5.08 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.225 1.41 . . . . 0.0 109.734 179.397 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.917 ' O ' HD23 ' A' ' 45' ' ' LEU . 0.4 OUTLIER -90.96 -140.63 0.16 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.882 0.372 . . . . 0.0 111.302 -179.518 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.917 HD23 ' O ' ' A' ' 44' ' ' ASN . 0.2 OUTLIER -147.32 149.16 32.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.978 -179.597 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.538 HE22 ' CG ' ' A' ' 40' ' ' ASP . 3.5 mp0 -148.83 136.78 20.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.674 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.424 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -66.18 87.19 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.768 -179.921 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.524 HD12 ' HB2' ' A' ' 38' ' ' PHE . 9.7 mt -86.57 124.07 40.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.047 0.451 . . . . 0.0 111.627 -179.803 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 63.7 m -93.12 110.68 22.18 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.202 178.442 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.62 130.5 37.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.37 0.605 . . . . 0.0 112.084 -178.509 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -100.01 -42.04 6.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.24 179.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.7 50.13 0.78 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.296 -179.473 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -73.7 93.36 2.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.891 0.376 . . . . 0.0 110.691 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.061 -179.821 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 CA-C-O 120.726 0.298 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.543 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 3.3 p-10 -156.45 152.18 27.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.016 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -67.79 164.4 19.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.033 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.44 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.8 m -152.65 45.87 0.71 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.241 -179.596 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.68 138.32 24.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.743 0.306 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 19.1 mmtt -143.76 114.65 7.76 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.539 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.44 ' O ' HG23 ' A' ' 7' ' ' VAL . 2.7 m -66.53 127.82 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.047 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -85.19 80.09 9.33 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.312 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' A' ' 11' ' ' TYR . 0.4 OUTLIER -57.29 -70.38 0.13 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.398 0.618 . . . . 0.0 110.042 -179.003 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 60.0 t-20 -51.92 86.15 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.707 178.964 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.618 ' O ' ' N ' ' A' ' 13' ' ' VAL . 1.7 t80 -177.8 97.34 0.22 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.452 -179.027 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.537 ' O ' ' C ' ' A' ' 13' ' ' VAL . 79.8 Cg_exo -45.94 75.65 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.814 2.342 . . . . 0.0 112.978 -179.574 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.618 ' N ' ' O ' ' A' ' 11' ' ' TYR . 15.9 t -7.86 -62.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 O-C-N 123.798 0.686 . . . . 0.0 112.52 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.565 ' OG ' ' N ' ' A' ' 15' ' ' LYS . 67.4 p 27.23 -92.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.481 -179.82 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.565 ' N ' ' OG ' ' A' ' 14' ' ' SER . 0.1 OUTLIER -68.9 156.49 38.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.54 -179.624 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 15' ' ' LYS . 1.7 m -172.59 -37.34 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.73 52.04 1.39 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.298 0.571 . . . . 0.0 109.785 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 20' ' ' ASN . 11.4 mt -161.95 96.24 1.0 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.282 -179.215 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.18 78.74 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.032 179.737 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.566 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.5 OUTLIER -162.01 -79.14 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.292 179.847 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.51 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.9 OUTLIER -22.75 -86.16 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.347 179.844 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.487 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 1.9 m -57.55 -52.38 65.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.163 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.84 -75.18 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.573 -179.103 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.566 ' N ' ' O ' ' A' ' 20' ' ' ASN . 1.0 OUTLIER -48.94 -57.13 6.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.724 -179.077 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 29' ' ' ASP . 34.6 m-20 -52.11 -56.44 14.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.336 -179.453 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.527 ' C ' ' H ' ' A' ' 28' ' ' LEU . 94.9 m -50.44 -53.06 32.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.029 0.442 . . . . 0.0 110.064 179.834 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -61.99 17.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.335 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 26' ' ' CYS . 7.4 tt -163.68 -40.82 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -179.759 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -67.2 -40.07 86.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.754 0.312 . . . . 0.0 110.764 -179.707 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -112.72 15.49 19.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.544 179.486 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.7 m170 52.04 44.37 29.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.852 -179.498 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.61 -154.87 0.24 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.896 0.379 . . . . 0.0 111.121 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 33.2 mtp85 -142.52 -2.99 1.05 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.831 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.3 p -175.32 -179.83 1.38 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.728 -179.94 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 156.73 167.95 18.68 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.337 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -178.51 174.99 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.903 0.382 . . . . 0.0 110.901 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.478 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -86.54 133.9 33.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.1 179.661 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -144.98 148.6 33.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.057 0.456 . . . . 0.0 111.44 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -75.44 -179.73 4.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.456 -179.531 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.517 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -154.85 -179.86 8.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.072 179.9 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HG3' ' H ' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -61.4 0.62 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.946 0.403 . . . . 0.0 110.462 -179.979 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.517 ' H ' ' C ' ' A' ' 40' ' ' ASP . 25.4 mtmm -102.2 -12.65 17.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.164 -179.886 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.477 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 15.7 ttp180 83.16 -5.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.612 -179.464 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -95.6 156.13 16.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.435 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.8 mp -91.44 157.4 17.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.037 0.446 . . . . 0.0 111.775 -179.568 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -146.03 143.7 29.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.786 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.2 m -79.34 97.96 6.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.675 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.7 mt -87.06 126.09 40.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.442 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 72.9 m -98.84 111.75 24.05 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.955 179.421 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -95.22 131.64 41.05 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.879 179.832 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -103.98 -37.01 7.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.862 -179.281 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.536 ' O ' ' N ' ' A' ' 54' ' ' TYR . 1.4 m -144.0 -11.49 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.706 -178.819 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 60.44 -71.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 110.88 -179.479 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 52' ' ' CYS . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.683 179.992 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.582 0 CA-C-O 120.739 0.304 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -64.9 -42.61 94.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.47 179.883 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -159.11 120.34 3.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.216 179.796 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.24 11.41 0.4 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.925 179.821 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.13 116.27 8.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.504 179.535 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.405 ' NZ ' ' OH ' ' A' ' 51' ' ' TYR . 11.2 pttm -152.46 135.99 16.04 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.253 -0.579 . . . . 0.0 112.1 -178.977 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.55 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.4 m -67.23 150.85 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.582 179.228 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.674 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -64.28 61.6 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.462 179.813 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.55 ' N ' ' O ' ' A' ' 7' ' ' VAL . 2.8 mt-10 16.76 -140.65 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.38 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.78 12.52 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -178.202 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.623 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 67.3 t80 -50.98 143.11 16.14 Favored Pre-proline 0 N--CA 1.467 0.387 0 O-C-N 121.952 -0.468 . . . . 0.0 109.786 179.597 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.756 ' O ' HG23 ' A' ' 13' ' ' VAL . 9.4 Cg_endo -48.16 -88.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.876 1.717 . . . . 0.0 112.179 -179.596 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.756 HG23 ' O ' ' A' ' 12' ' ' PRO . 71.0 t 117.47 -8.12 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.638 1.175 . . . . 0.0 110.728 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 p -66.28 25.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.24 179.69 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.611 ' H ' ' C ' ' A' ' 13' ' ' VAL . 0.6 OUTLIER -172.02 99.57 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.96 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -171.25 27.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.815 -179.097 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.513 ' N ' ' CD ' ' A' ' 17' ' ' GLN . 1.7 mm100 -76.16 17.23 0.36 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.768 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.402 ' H ' ' C ' ' A' ' 16' ' ' CYS . 7.1 mt -163.42 -90.29 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.972 -179.848 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.92 -150.97 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.147 0.499 . . . . 0.0 110.995 -179.082 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.552 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.1 OUTLIER 67.0 -75.47 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.914 179.899 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.552 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 4.8 tp-100 -38.13 -83.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 -179.667 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.623 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -57.68 -40.74 80.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 110.737 179.416 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.411 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -56.66 -76.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.858 179.865 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -48.28 -40.38 24.67 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.845 179.946 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.439 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 65.6 m-20 -55.04 -68.52 0.18 Allowed 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.055 -179.787 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.674 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -54.52 -39.33 67.51 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.793 179.824 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? -60.77 6.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.088 179.723 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.486 ' H ' ' C ' ' A' ' 26' ' ' CYS . 17.4 tp -163.38 -36.77 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -179.546 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -67.68 -13.34 62.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.068 0.461 . . . . 0.0 110.351 -179.918 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -141.31 8.85 2.04 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.074 179.398 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 56.8 50.69 12.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.959 179.925 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.85 173.8 9.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.764 179.83 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -93.39 -51.2 5.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.294 179.886 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.3 p -160.96 126.57 3.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 179.871 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.411 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . -132.15 167.57 22.86 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.878 -179.785 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -176.76 161.18 2.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.358 0.599 . . . . 0.0 111.003 -179.885 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -86.94 128.32 35.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.764 -179.737 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -125.62 148.75 48.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.043 0.449 . . . . 0.0 111.109 -179.725 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.625 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 25.2 m-85 -99.26 152.6 19.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.131 179.444 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 44' ' ' ASN . 0.3 OUTLIER -95.92 172.63 7.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.176 179.147 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -61.66 -2.02 0.71 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.035 -179.593 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.434 ' H ' ' C ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -97.59 -80.06 0.45 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.301 179.384 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.05 21.59 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.463 179.601 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.625 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -95.26 -165.1 1.24 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.767 0.318 . . . . 0.0 111.197 -179.964 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.551 HD11 ' CZ ' ' A' ' 39' ' ' TYR . 1.4 mt -146.22 147.06 31.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 0.0 111.057 -179.5 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -148.75 125.4 11.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.578 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 65.9 m -77.74 95.91 4.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.819 -179.92 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.436 HD13 HG12 ' A' ' 7' ' ' VAL . 3.3 mm -83.77 114.61 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.95 -179.428 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 11.5 m -106.04 111.84 24.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.751 0.31 . . . . 0.0 110.317 178.984 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -96.82 153.85 17.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.064 -179.784 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.405 ' OH ' ' NZ ' ' A' ' 6' ' ' LYS . 37.8 m-85 -121.06 -25.95 5.23 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.966 -178.889 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.2 m -93.55 -110.08 0.11 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.872 0.367 . . . . 0.0 111.245 -179.71 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -173.89 84.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.747 -179.473 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.336 -0.84 . . . . 0.0 110.775 -179.908 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.641 0 CA-C-O 120.867 0.365 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 0.3 OUTLIER -88.13 176.78 7.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.889 -179.875 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.22 127.59 7.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.293 179.96 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.416 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 1.2 m -155.24 33.63 0.38 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.144 0.497 . . . . 0.0 111.198 -179.606 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 tptm -98.43 132.06 44.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.536 179.686 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -149.26 117.42 6.39 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.887 0.375 . . . . 0.0 111.516 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.4 143.41 15.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.16 -179.908 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.407 ' CD1' ' NZ ' ' A' ' 30' ' ' LYS . 1.0 OUTLIER -86.34 109.42 18.98 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 177.025 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.505 ' O ' ' O ' ' A' ' 10' ' ' ASN . 2.5 mt-10 -55.1 -174.79 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.477 -178.916 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.505 ' O ' ' O ' ' A' ' 9' ' ' GLU . 5.5 p30 17.57 104.6 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.855 0.722 . . . . 0.0 111.923 -179.575 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.532 ' C ' ' H ' ' A' ' 13' ' ' VAL . 0.1 OUTLIER -179.86 81.57 0.19 Allowed Pre-proline 0 CA--C 1.534 0.348 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.272 -179.636 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.52 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 52.7 Cg_exo -56.79 5.93 0.06 OUTLIER 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 123.235 2.624 . . . . 0.0 113.822 -178.793 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.532 ' H ' ' C ' ' A' ' 11' ' ' TYR . 90.7 t 101.87 -72.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.201 1.001 . . . . 0.0 111.505 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.491 ' C ' ' O ' ' A' ' 13' ' ' VAL . 7.0 p 27.72 89.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.491 ' CB ' ' O ' ' A' ' 14' ' ' SER . 1.0 OUTLIER 92.86 -123.63 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.426 -179.426 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER 78.94 -49.18 0.43 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 179.528 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.88 -12.88 8.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.082 0.468 . . . . 0.0 110.659 -179.568 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.628 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 0.8 OUTLIER -71.82 -45.08 62.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.094 179.885 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.628 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 101.98 3.86 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 O-C-N 123.773 0.67 . . . . 0.0 110.802 -179.619 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.595 ' O ' ' N ' ' A' ' 22' ' ' CYS . 5.3 t-20 -97.03 -118.24 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.744 179.81 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.539 ' C ' ' O ' ' A' ' 20' ' ' ASN . 14.7 mm100 -1.14 -65.31 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.952 0.782 . . . . 0.0 112.326 179.677 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.595 ' N ' ' O ' ' A' ' 20' ' ' ASN . 6.4 t -57.11 -69.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.93 179.887 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.41 ' N ' ' O ' ' A' ' 20' ' ' ASN . 25.0 t30 -50.45 -51.06 50.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.27 179.933 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.49 -47.31 76.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.64 179.367 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.429 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 97.3 m-20 -57.19 -55.3 36.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.871 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.888 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 57.0 m -56.06 -47.57 77.68 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.869 179.724 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.86 8.83 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.112 178.902 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.673 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -162.79 -132.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.677 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.558 ' H ' HD13 ' A' ' 28' ' ' LEU . 1.6 m-20 39.85 -77.2 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.461 0.476 . . . . 0.0 111.897 -179.889 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.673 ' N ' ' O ' ' A' ' 28' ' ' LEU . 12.6 mttp -91.99 -4.91 53.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.719 0.295 . . . . 0.0 110.981 -179.769 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.526 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.6 OUTLIER 82.99 44.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.642 179.391 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.888 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -88.0 172.7 9.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.26 179.276 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.41 HH21 ' HB2' ' A' ' 53' ' ' GLU . 2.9 tmm_? -95.73 -29.25 14.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.009 0.433 . . . . 0.0 110.49 179.921 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.7 p -174.54 -164.67 0.18 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.653 179.882 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 168.54 -178.5 42.01 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.348 -179.909 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -178.22 160.7 1.38 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.868 0.366 . . . . 0.0 110.622 179.969 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 137.27 32.48 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.566 -179.81 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -146.39 131.78 18.61 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.147 0.499 . . . . 0.0 112.202 -179.405 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.535 ' CZ ' ' O ' ' A' ' 43' ' ' ARG . 1.2 m-85 -39.04 163.51 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.598 -179.985 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 44' ' ' ASN . 19.5 p30 -136.87 -161.76 1.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.192 179.504 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -63.1 -28.33 70.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.146 -179.664 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 24.0 mmmt -99.67 28.17 4.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.186 -179.794 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.535 ' O ' ' CZ ' ' A' ' 39' ' ' TYR . 28.8 mtm180 59.74 5.8 0.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.433 179.644 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 73.2 m-80 -94.96 145.94 24.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.968 0.413 . . . . 0.0 111.215 -179.7 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.743 ' H ' HD23 ' A' ' 45' ' ' LEU . 0.3 OUTLIER -91.34 120.79 32.52 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.072 0.768 . . . . 0.0 113.072 -178.622 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -98.61 148.57 23.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.542 178.306 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -78.58 98.14 6.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.629 -179.383 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.4 mt -87.83 116.73 30.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.25 179.397 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 67.6 m -96.52 120.89 37.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.35 179.924 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.418 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 5.8 t70 -97.25 134.59 40.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.346 179.359 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -104.65 -28.43 11.23 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.667 -178.943 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.416 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m -144.75 67.73 1.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 0.0 111.384 -179.495 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.446 ' O ' ' C ' ' A' ' 54' ' ' TYR . 2.6 tp10 50.51 -95.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.954 179.595 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.446 ' C ' ' O ' ' A' ' 53' ' ' GLU . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.176 -0.916 . . . . 0.0 110.959 -179.957 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.611 0 CA-C-O 120.823 0.344 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.406 ' O ' ' O ' ' A' ' 3' ' ' LYS . 72.6 m-20 -149.23 -81.25 0.12 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.041 -179.775 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.406 ' O ' ' O ' ' A' ' 2' ' ' ASP . 7.6 tmtt? 50.37 101.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.731 -179.859 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 172.39 24.86 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.044 -179.396 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.481 ' CD ' ' N ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -140.47 151.14 44.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.939 0.4 . . . . 0.0 111.8 -179.363 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -148.89 133.75 17.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.504 -179.771 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.8 m -65.66 139.75 20.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.649 179.778 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.474 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -81.51 54.33 2.32 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 178.859 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.609 ' O ' ' N ' ' A' ' 11' ' ' TYR . 13.1 mt-10 25.22 -145.59 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.784 -179.968 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -57.62 58.05 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.104 -179.51 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.609 ' N ' ' O ' ' A' ' 9' ' ' GLU . 35.4 t80 -56.19 121.33 41.16 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 110.513 -0.18 . . . . 0.0 110.513 179.424 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -41.02 90.12 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.547 1.498 . . . . 0.0 111.292 179.096 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.537 ' N ' ' O ' ' A' ' 11' ' ' TYR . 2.2 t -51.45 95.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.222 0.534 . . . . 0.0 111.11 -179.276 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 91.0 p -175.25 130.66 0.29 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.54 -179.903 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.498 ' O ' ' C ' ' A' ' 16' ' ' CYS . 26.8 mttt 87.96 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.764 0.665 . . . . 0.0 110.919 -179.537 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.498 ' C ' ' O ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER 25.2 98.01 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.344 0.403 . . . . 0.0 111.282 179.953 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.426 ' O ' ' C ' ' A' ' 18' ' ' LEU . 31.7 mt-30 -120.65 50.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.977 -179.981 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.617 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 26.1 mt 36.5 89.83 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.909 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 103.28 149.77 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 O-C-N 124.107 0.879 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.608 ' OD1' ' N ' ' A' ' 21' ' ' GLN . 0.2 OUTLIER 84.46 -68.57 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.532 179.547 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.608 ' N ' ' OD1' ' A' ' 20' ' ' ASN . 6.7 mm-40 -49.43 -79.06 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.672 0.272 . . . . 0.0 111.011 -179.542 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.1 m -55.23 -39.17 69.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.916 0.388 . . . . 0.0 110.52 179.956 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -55.65 -81.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.594 179.45 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.72 -46.8 30.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.232 -179.855 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.444 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 3.6 m-20 -51.82 -66.53 0.37 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.461 0.172 . . . . 0.0 110.93 -179.66 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.554 ' C ' ' H ' ' A' ' 28' ' ' LEU . 28.8 m -55.36 -36.54 66.44 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.384 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.9 tttp -60.48 6.14 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.17 179.297 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.554 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.5 tp -159.64 -34.16 0.06 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.288 -179.384 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -70.61 -56.82 5.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.004 0.43 . . . . 0.0 110.111 179.293 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.436 ' O ' ' C ' ' A' ' 31' ' ' HIS . 2.1 mptt -102.61 21.3 15.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.336 179.452 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.436 ' C ' ' O ' ' A' ' 30' ' ' LYS . 1.4 p80 35.43 45.17 0.21 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.154 0.502 . . . . 0.0 110.796 -179.943 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.603 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.09 -132.79 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.608 179.798 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -139.32 -31.12 0.7 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.294 179.382 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.2 p -167.33 -164.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.796 -179.931 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 174.09 -171.31 44.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -177.15 154.33 1.05 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.852 0.358 . . . . 0.0 110.983 -179.969 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.635 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 92.2 m -85.52 96.71 9.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.566 179.976 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.419 ' HB2' HD12 ' A' ' 48' ' ' ILE . 37.0 m-85 -108.12 163.0 13.54 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.194 -179.872 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.57 ' CE2' HD23 ' A' ' 45' ' ' LEU . 27.5 m-85 -87.03 -22.77 25.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.769 179.745 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.506 ' O ' ' O ' ' A' ' 39' ' ' TYR . 0.1 OUTLIER 48.0 171.96 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.017 179.803 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -65.74 39.58 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.469 -179.681 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.489 ' H ' ' C ' ' A' ' 40' ' ' ASP . 16.2 mtmt -144.64 -1.76 0.88 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.563 -179.666 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 41.76 65.91 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.233 0.539 . . . . 0.0 109.934 -179.515 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -138.94 0.97 2.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.325 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.57 HD23 ' CE2' ' A' ' 39' ' ' TYR . 1.1 tm? 51.63 63.86 2.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.012 0.434 . . . . 0.0 110.377 179.218 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -95.03 169.86 9.82 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.418 -179.619 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -96.69 114.58 26.23 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.404 -179.753 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.419 HD12 ' HB2' ' A' ' 38' ' ' PHE . 23.4 mt -90.6 132.09 36.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.542 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 86.9 m -100.95 112.86 25.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.753 179.482 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.603 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 6.8 t70 -94.09 151.94 19.13 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.726 179.829 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -124.0 -29.3 3.65 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.251 -178.783 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.45 ' O ' ' C ' ' A' ' 53' ' ' GLU . 35.1 m -93.39 -103.39 0.13 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.766 0.317 . . . . 0.0 111.143 -179.588 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.45 ' C ' ' O ' ' A' ' 52' ' ' CYS . 16.9 tt0 -32.41 112.36 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.207 -179.553 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.012 -179.945 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 120.847 0.356 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.484 ' O ' ' O ' ' A' ' 3' ' ' LYS . 22.8 t0 69.47 -79.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.711 -179.736 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 2' ' ' ASP . 11.0 tptt 33.29 -156.69 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.058 -179.938 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.42 ' H ' ' CG ' ' A' ' 3' ' ' LYS . 93.4 m -149.48 46.18 0.96 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.904 0.383 . . . . 0.0 111.21 -179.503 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' CD ' ' A' ' 5' ' ' LYS . 2.5 tmtt? -145.94 131.46 18.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.13 114.26 5.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.07 -179.949 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.417 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.0 OUTLIER -64.67 130.95 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.304 179.956 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.531 ' O ' ' O ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -71.59 64.26 0.44 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.03 0.443 . . . . 0.0 110.344 179.781 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' N ' ' A' ' 11' ' ' TYR . 3.4 mt-10 29.26 -156.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.147 179.366 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.44 47.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.494 -0.775 . . . . 0.0 112.386 -179.315 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.605 ' O ' ' O ' ' A' ' 12' ' ' PRO . 58.2 t80 -52.25 145.3 19.45 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.183 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.605 ' O ' ' O ' ' A' ' 11' ' ' TYR . 73.8 Cg_exo -49.58 -139.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.895 1.73 . . . . 0.0 112.597 179.863 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.587 ' C ' ' H ' ' A' ' 15' ' ' LYS . 0.5 OUTLIER -179.26 -19.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.743 179.852 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 26.3 p -64.24 19.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -179.906 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.587 ' H ' ' C ' ' A' ' 13' ' ' VAL . 1.7 tttm -173.89 104.76 0.12 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.925 0.393 . . . . 0.0 111.502 -179.909 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 179.84 110.89 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.072 179.424 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -127.46 -54.02 1.35 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.822 -179.649 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.679 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 0.4 OUTLIER -179.31 89.44 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.794 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.679 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . 96.71 174.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.491 0.662 . . . . 0.0 112.62 178.219 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 71.89 -78.31 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.819 179.265 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -39.04 -85.03 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.581 -179.051 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 1.8 m -58.15 -40.39 81.27 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.701 -179.346 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -52.98 -70.32 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.529 -179.506 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.572 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -51.55 -54.61 25.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.705 0.288 . . . . 0.0 111.114 -179.551 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.516 ' O ' ' N ' ' A' ' 29' ' ' ASP . 29.9 m-20 -49.57 -60.69 2.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.926 -179.514 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 37.9 m -54.98 -32.7 61.83 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.97 179.65 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -59.24 0.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.318 179.512 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -165.05 -37.12 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 -179.204 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.516 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.7 OUTLIER -65.84 -16.87 64.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.767 0.318 . . . . 0.0 111.101 -179.314 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.3 mmtt -142.6 5.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.967 179.925 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.8 36.9 19.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.767 179.897 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.38 -169.76 2.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.387 -179.744 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.434 ' H ' ' HA ' ' A' ' 51' ' ' TYR . 8.4 tpm_? -97.85 -20.9 17.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.655 179.992 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.7 p 171.31 -163.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.334 -179.831 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -179.65 -175.22 46.28 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.589 179.901 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -175.81 158.48 2.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.813 0.339 . . . . 0.0 110.407 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.64 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 3.8 m -87.52 130.53 34.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.412 -179.49 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -149.21 165.84 30.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.776 179.555 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.611 ' CD2' ' O ' ' A' ' 44' ' ' ASN . 2.3 m-85 -81.88 166.86 19.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.35 179.705 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -124.38 87.08 2.66 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.162 0.506 . . . . 0.0 111.035 179.956 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' A' ' 40' ' ' ASP . 59.1 mt-10 21.25 41.22 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.5 179.731 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.605 ' N ' ' O ' ' A' ' 40' ' ' ASP . 5.0 ttmm -147.13 -76.47 0.18 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.949 0.404 . . . . 0.0 110.979 -179.976 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.433 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.2 OUTLIER 162.71 58.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.558 -179.959 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.611 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 20.2 m-80 -141.01 -164.05 1.67 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.337 -179.684 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.3 tp -152.64 82.77 1.23 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.857 -179.656 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -92.33 165.63 12.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.21 -179.73 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.0 110.47 22.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.342 -179.696 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.575 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.9 mp -89.22 122.25 40.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.209 179.541 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.8 m -93.57 113.39 25.49 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.902 0.382 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -95.2 139.83 30.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.889 -179.819 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.434 ' HA ' ' H ' ' A' ' 33' ' ' ARG . 67.6 m-85 -106.95 -11.95 15.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.167 -179.62 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.555 ' O ' ' CB ' ' A' ' 53' ' ' GLU . 56.5 m -143.09 -108.87 0.13 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.263 -179.448 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.555 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 5.3 tt0 89.97 -76.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 -179.662 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.435 ' C ' ' O ' ' A' ' 53' ' ' GLU . 3.2 m-85 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.055 179.747 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 120.704 0.288 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.485 ' O ' ' O ' ' A' ' 3' ' ' LYS . 3.6 t0 -59.94 -39.65 86.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.27 -179.68 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.57 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 11.8 tppt? 57.57 134.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.72 -179.784 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.57 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.4 m 175.66 -20.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.633 -179.815 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.4 122.56 40.58 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.905 179.12 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' HZ3' ' HD2' ' A' ' 3' ' ' LYS . 2.5 mttm -148.78 144.49 27.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.833 0.349 . . . . 0.0 111.206 -179.064 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.509 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 21.7 m -62.24 162.25 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 CA-C-O 121.165 0.507 . . . . 0.0 111.068 179.52 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.539 ' CD1' ' C ' ' A' ' 8' ' ' TYR . 3.5 p90 -67.71 -29.56 68.84 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.799 -179.653 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.548 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER 26.81 101.87 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.538 -177.458 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.548 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 49.3 m-20 104.91 79.76 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.832 179.903 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.55 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 18.7 t80 170.42 96.47 0.04 OUTLIER Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.512 179.125 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.579 ' O ' ' N ' ' A' ' 14' ' ' SER . 96.1 Cg_exo -44.86 112.1 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.208 1.938 . . . . 0.0 112.399 -179.996 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.59 73.38 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.429 -179.838 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.579 ' N ' ' O ' ' A' ' 12' ' ' PRO . 9.2 p -63.79 -24.4 67.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.634 179.641 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -173.48 165.11 4.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.159 179.645 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -173.42 10.37 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.604 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -89.0 -33.44 17.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 0.0 110.719 179.863 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.58 ' O ' ' CB ' ' A' ' 19' ' ' ALA . 3.3 mt -70.89 -58.61 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.547 -179.941 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.58 ' CB ' ' O ' ' A' ' 18' ' ' LEU . . . 105.35 59.71 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.884 0.74 . . . . 0.0 110.974 -179.256 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.775 HD22 ' N ' ' A' ' 21' ' ' GLN . 0.5 OUTLIER -155.35 -51.86 0.09 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.702 179.695 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.775 ' N ' HD22 ' A' ' 20' ' ' ASN . 0.9 OUTLIER -47.93 -76.74 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.475 179.926 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.55 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 0.1 OUTLIER -59.74 -42.38 93.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.734 0.302 . . . . 0.0 110.939 179.789 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.599 ' ND2' ' O ' ' A' ' 35' ' ' GLY . 2.7 t-20 -54.7 -76.97 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.106 179.883 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.534 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -48.95 -37.81 21.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.346 179.832 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.598 ' O ' ' N ' ' A' ' 29' ' ' ASP . 68.0 m-20 -55.5 -69.58 0.13 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.655 179.741 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.52 ' C ' ' H ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -51.66 -38.16 53.65 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.904 179.828 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.408 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 3.5 mtpt -57.93 3.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.117 179.368 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.52 ' H ' ' C ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -165.01 -43.64 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.864 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.598 ' N ' ' O ' ' A' ' 25' ' ' ASP . 84.2 m-20 -68.17 -8.08 35.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.699 0.285 . . . . 0.0 111.301 -179.429 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.8 mttp -140.29 13.32 2.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.779 179.925 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 22.0 m170 59.94 38.17 21.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.977 179.321 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -89.49 -166.13 1.52 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.732 -0.213 . . . . 0.0 110.649 179.181 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.408 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 46.7 ttt180 -129.54 -48.26 1.17 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.972 0.415 . . . . 0.0 110.448 179.558 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.447 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 1.1 p -158.53 124.39 4.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.268 179.531 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.599 ' O ' ' ND2' ' A' ' 23' ' ' ASN . . . -130.18 -176.53 14.46 Favored Glycine 0 C--N 1.333 0.411 0 C-N-CA 120.38 -0.914 . . . . 0.0 113.649 -179.234 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -174.93 158.77 2.59 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.537 0.208 . . . . 0.0 110.776 179.929 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 139.03 30.93 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.606 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -149.29 154.34 38.87 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.846 179.42 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.511 ' HB3' HD12 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -163.52 172.58 14.22 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.902 -179.43 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.524 ' C ' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -139.4 -160.65 1.09 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.818 0.342 . . . . 0.0 111.241 -178.964 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.473 ' CG ' ' O ' ' A' ' 41' ' ' GLU . 38.5 tt0 -60.05 3.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.115 -179.417 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.541 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.3 OUTLIER -94.18 4.65 53.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.233 0.539 . . . . 0.0 109.925 179.48 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 46.33 10.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.015 -179.8 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.541 ' H ' ' C ' ' A' ' 42' ' ' LYS . 10.5 m120 -94.68 97.19 9.91 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.143 0.497 . . . . 0.0 110.274 179.462 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.511 HD12 ' HB3' ' A' ' 39' ' ' TYR . 6.4 tp -89.47 130.31 35.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.677 -178.942 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -137.28 154.57 50.08 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.152 -179.009 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -92.94 111.78 23.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.33 179.834 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.5 mm -80.46 109.94 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.365 179.059 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.2 m -96.87 115.35 27.27 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.47 0.481 . . . . 0.0 110.721 -179.444 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' A' ' 34' ' ' SER . 1.0 OUTLIER -95.24 131.83 40.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.176 -179.67 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -101.9 -17.4 16.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.178 -179.42 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.9 m -144.1 -19.16 0.57 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.489 -179.977 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 59.28 71.14 0.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.731 0.301 . . . . 0.0 110.906 -179.88 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.146 -0.93 . . . . 0.0 110.767 179.945 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.508 0 CA-C-O 120.841 0.353 . . . . 0.0 111.357 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.539 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 0.0 OUTLIER 61.39 156.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.366 179.851 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.74 36.2 2.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.278 179.972 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.489 ' HB3' ' H ' ' A' ' 52' ' ' CYS . 3.5 m 47.21 22.52 0.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.938 179.785 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.7 137.77 32.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.916 0.388 . . . . 0.0 111.481 -179.606 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.1 mttp -149.22 123.01 9.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.497 179.681 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.15 142.63 16.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -81.26 103.16 10.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.435 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.54 ' O ' ' C ' ' A' ' 10' ' ' ASN . 15.4 mm-40 -59.54 168.28 1.67 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.399 -179.165 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.54 ' C ' ' O ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER 11.42 108.21 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 O-C-N 123.849 0.718 . . . . 0.0 111.883 -179.567 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 13' ' ' VAL . 0.7 OUTLIER -177.97 143.48 0.48 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.698 -179.789 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.414 ' C ' ' O ' ' A' ' 11' ' ' TYR . 33.0 Cg_exo -28.98 83.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.179 2.586 . . . . 0.0 113.316 -179.686 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.571 ' N ' ' O ' ' A' ' 11' ' ' TYR . 0.8 OUTLIER -58.26 -39.48 73.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.148 179.468 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.23 -39.25 94.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.208 -179.763 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.48 91.29 0.12 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.914 0.388 . . . . 0.0 110.868 -179.908 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -172.86 111.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.392 -179.689 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -149.13 -22.4 0.3 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.504 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.486 ' O ' ' OD1' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -166.22 176.73 7.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.212 0.529 . . . . 0.0 111.518 -179.27 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.475 ' C ' ' OD1' ' A' ' 20' ' ' ASN . . . -58.71 103.45 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.85 -179.999 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.547 ' O ' ' N ' ' A' ' 24' ' ' TYR . 1.6 p-10 176.24 -88.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.973 178.982 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.766 HE21 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -27.57 -85.63 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.418 -0.113 . . . . 0.0 111.231 -179.84 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.627 ' N ' HE21 ' A' ' 21' ' ' GLN . 0.8 OUTLIER -52.33 -56.58 13.9 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.6 0.238 . . . . 0.0 111.269 -179.77 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.548 HD22 ' N ' ' A' ' 35' ' ' GLY . 3.9 t-20 -49.05 -74.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.102 0.477 . . . . 0.0 110.49 179.968 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.547 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -49.84 -42.49 47.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.399 179.685 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.499 ' O ' ' N ' ' A' ' 29' ' ' ASP . 69.1 m-20 -55.19 -66.47 0.4 Allowed 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.649 -179.688 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 22' ' ' CYS . 1.8 m -52.69 -39.68 62.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.26 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.0 tptm -57.16 2.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.151 179.849 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.499 ' H ' ' C ' ' A' ' 26' ' ' CYS . 64.0 tp -163.78 -37.56 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 179.963 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.499 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -66.81 -51.62 53.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.891 0.377 . . . . 0.0 110.505 179.926 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.519 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -106.12 6.48 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.306 179.8 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.519 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER 47.12 49.28 15.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.703 -179.859 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.523 ' HB1' ' O ' ' A' ' 50' ' ' ASP . . . -86.55 -127.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.444 179.37 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.25 -42.89 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.993 0.425 . . . . 0.0 110.623 179.924 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 p -158.43 -163.51 1.29 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.32 179.964 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.548 ' N ' HD22 ' A' ' 23' ' ' ASN . . . 167.14 174.69 36.53 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.525 179.97 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -175.57 168.73 3.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.778 0.323 . . . . 0.0 110.561 -179.951 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.5 m -88.06 147.49 24.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.001 0.429 . . . . 0.0 111.277 -179.469 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -146.93 131.41 17.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.606 179.812 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.617 ' CD1' ' O ' ' A' ' 44' ' ' ASN . 21.1 m-85 -74.14 -172.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.399 -179.444 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.502 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 0.8 OUTLIER -163.47 -171.48 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.882 -179.932 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.13 -20.0 63.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.261 -179.638 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 43' ' ' ARG . 19.7 mmtt -99.43 29.11 4.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.046 179.871 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LYS . 11.9 ttt180 35.76 34.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.83 -179.957 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.617 ' O ' ' CD1' ' A' ' 39' ' ' TYR . 2.5 m-20 -94.6 -162.84 0.98 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 -179.949 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.0 mt -146.22 100.06 3.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.874 0.369 . . . . 0.0 110.991 -179.58 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -92.96 149.69 21.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.249 179.842 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.51 110.31 22.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.116 -179.552 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.407 ' O ' ' CA ' ' A' ' 35' ' ' GLY . 9.6 mm -87.95 128.26 40.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.902 179.984 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 61.1 m -108.39 116.65 32.36 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 179.513 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.523 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -94.82 133.39 38.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.915 0.388 . . . . 0.0 110.116 179.324 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -100.66 -33.8 10.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.2 -178.751 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.489 ' H ' ' HB3' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -148.62 -93.26 0.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.654 -179.8 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 179.28 -34.26 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.909 0.385 . . . . 0.0 110.165 179.819 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.295 -0.86 . . . . 0.0 110.615 -179.85 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.622 0 CA-C-O 120.756 0.312 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.81 -103.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.86 -179.939 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.599 ' O ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -144.51 131.62 20.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.085 -179.807 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 3' ' ' LYS . 1.3 m 159.53 45.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.981 -179.99 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -143.97 92.96 2.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.594 -179.71 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -96.3 127.46 42.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.691 0.281 . . . . 0.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.2 m -66.03 133.65 30.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 112.091 -179.787 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.483 ' O ' ' O ' ' A' ' 9' ' ' GLU . 13.5 t80 -77.09 93.84 3.94 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.688 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' O ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -47.96 -179.21 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.303 -177.922 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.579 ' O ' ' O ' ' A' ' 9' ' ' GLU . 43.5 m-20 16.34 109.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.675 0.609 . . . . 0.0 111.987 -179.376 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.674 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 12.8 t80 -173.07 144.52 1.18 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.144 -179.071 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.93 ' O ' HG23 ' A' ' 13' ' ' VAL . 81.2 Cg_exo -43.56 -134.86 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 123.108 2.539 . . . . 0.0 113.831 -179.378 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.93 HG23 ' O ' ' A' ' 12' ' ' PRO . 2.2 t -177.46 -56.52 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.879 -179.031 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.8 p -60.08 66.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.865 -178.729 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.697 ' O ' ' N ' ' A' ' 17' ' ' GLN . 4.5 mttm -174.47 -68.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.29 179.201 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.721 ' O ' ' N ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER 13.04 -66.5 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 178.94 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.697 ' N ' ' O ' ' A' ' 15' ' ' LYS . 23.4 mt-30 -54.65 51.52 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.638 0.586 . . . . 0.0 111.842 -178.744 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.721 ' N ' ' O ' ' A' ' 16' ' ' CYS . 11.7 mt -165.45 98.79 0.7 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.606 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.51 86.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.849 -179.424 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.612 ' O ' ' N ' ' A' ' 22' ' ' CYS . 3.7 t-20 -173.51 -78.12 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.816 -179.757 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.607 ' O ' ' SG ' ' A' ' 22' ' ' CYS . 0.2 OUTLIER -60.46 41.4 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.521 -179.921 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 15.6 m -170.23 -59.01 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.147 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.432 ' O ' ' CB ' ' A' ' 27' ' ' LYS . 1.0 OUTLIER -56.69 -54.54 45.03 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.576 178.112 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.544 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.92 -47.91 76.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.028 178.957 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.628 ' O ' ' N ' ' A' ' 29' ' ' ASP . 4.0 m-20 -58.09 -68.75 0.22 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.409 -179.983 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.504 ' C ' ' H ' ' A' ' 28' ' ' LEU . 56.2 m -51.87 -41.46 61.89 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.023 -179.94 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.455 ' CG ' ' O ' ' A' ' 27' ' ' LYS . 17.0 tttp -59.83 6.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 0.0 112.08 179.776 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 26' ' ' CYS . 29.2 tp -164.68 -41.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.532 -0.467 . . . . 0.0 112.121 -179.396 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.628 ' N ' ' O ' ' A' ' 25' ' ' ASP . 55.4 m-20 -69.27 -12.98 62.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.77 -0.195 . . . . 0.0 111.29 -179.746 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.548 ' C ' ' CG ' ' A' ' 31' ' ' HIS . 1.1 mptm? -138.19 6.05 2.56 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.831 0.348 . . . . 0.0 110.639 179.94 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.548 ' CG ' ' C ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 52.38 35.52 17.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.231 0.539 . . . . 0.0 110.447 -179.818 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -85.53 -167.22 1.76 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.649 179.702 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.01 -31.04 13.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.11 0.481 . . . . 0.0 109.856 179.63 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -171.93 -175.16 1.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.836 179.719 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.429 ' N ' ' HA ' ' A' ' 23' ' ' ASN . . . -152.11 95.23 0.15 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 119.965 -1.112 . . . . 0.0 113.519 -179.733 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.598 ' CG ' ' H ' ' A' ' 37' ' ' CYS . 0.5 OUTLIER -74.76 -159.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.369 0.604 . . . . 0.0 111.894 179.775 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.701 ' SG ' ' SG ' ' A' ' 22' ' ' CYS . 1.2 m -153.25 137.69 16.73 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.305 179.559 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -150.71 158.91 44.71 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -178.538 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.764 ' CG ' ' N ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -169.75 -153.71 0.11 Allowed 'General case' 0 C--N 1.343 0.318 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.228 179.548 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.764 ' N ' ' CG ' ' A' ' 39' ' ' TYR . 0.2 OUTLIER 175.12 95.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.63 0.252 . . . . 0.0 111.131 179.333 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.411 ' CB ' ' O ' ' A' ' 40' ' ' ASP . 8.5 mt-10 87.11 -70.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.704 179.565 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.642 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -150.38 29.23 0.71 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -179.665 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.643 ' C ' ' H ' ' A' ' 45' ' ' LEU . 0.0 OUTLIER -65.11 16.19 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.954 -179.328 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.642 ' H ' ' C ' ' A' ' 42' ' ' LYS . 30.4 m120 63.15 -15.82 0.06 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.261 -179.919 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.656 HD12 ' N ' ' A' ' 46' ' ' GLN . 4.3 tp 59.5 133.43 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.904 177.873 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.656 ' N ' HD12 ' A' ' 45' ' ' LEU . 1.8 mp0 -141.34 165.05 28.59 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.555 0.693 . . . . 0.0 112.571 -178.514 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.674 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 63.0 m -80.65 110.15 15.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.037 -179.965 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.423 ' O ' ' N ' ' A' ' 36' ' ' GLU . 1.4 mp -93.6 126.23 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 179.888 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 98.5 m -88.98 117.23 27.84 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.439 179.688 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.573 ' OD1' ' N ' ' A' ' 53' ' ' GLU . 6.8 t70 -93.48 121.13 34.57 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.386 179.481 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -100.38 -17.36 17.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.931 -179.121 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.475 ' O ' ' C ' ' A' ' 53' ' ' GLU . 5.7 m -141.83 56.08 1.49 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.142 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.573 ' N ' ' OD1' ' A' ' 50' ' ' ASP . 1.9 tm-20 28.85 -92.75 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.422 179.332 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.458 ' N ' ' O ' ' A' ' 52' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.77 -179.9 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.59 0 CA-C-O 120.752 0.31 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.529 ' CG ' ' H ' ' A' ' 3' ' ' LYS . 15.4 p30 -147.79 -82.86 0.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.742 179.7 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.589 ' O ' ' NZ ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -86.09 111.29 20.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.072 0.463 . . . . 0.0 110.877 179.984 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -45.88 -31.52 2.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.481 179.942 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -90.86 133.63 35.08 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.196 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.589 ' NZ ' ' O ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -146.79 122.56 10.57 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.087 178.786 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.0 m -60.87 145.33 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 0.0 111.561 -179.695 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.523 ' O ' ' O ' ' A' ' 9' ' ' GLU . 0.9 OUTLIER -87.64 60.35 5.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.001 179.418 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.552 ' C ' ' H ' ' A' ' 11' ' ' TYR . 35.5 mt-10 30.57 -158.61 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.021 179.707 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.422 ' OD1' ' O ' ' A' ' 10' ' ' ASN . 14.7 p30 -58.48 34.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.649 -179.149 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.677 ' CE2' ' SG ' ' A' ' 47' ' ' CYS . 5.5 t80 -50.92 135.16 28.22 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.486 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.447 ' C ' ' O ' ' A' ' 11' ' ' TYR . 39.9 Cg_exo -30.95 84.98 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.329 2.02 . . . . 0.0 112.318 179.512 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.605 ' N ' ' O ' ' A' ' 11' ' ' TYR . 42.9 t -55.77 -15.64 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.956 -179.536 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.4 p -62.16 -93.71 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.8 -179.196 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -67.82 153.25 44.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.331 0.586 . . . . 0.0 112.35 -178.793 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -174.52 -67.99 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.471 179.375 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.413 ' O ' ' C ' ' A' ' 18' ' ' LEU . 6.0 mm100 56.37 28.17 13.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.016 0.436 . . . . 0.0 111.065 179.59 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.659 HD23 ' H ' ' A' ' 37' ' ' CYS . 40.4 mt 35.59 75.9 0.05 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.22 179.542 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 20' ' ' ASN . . . -178.56 -147.94 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.343 179.719 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.548 ' O ' ' C ' ' A' ' 21' ' ' GLN . 3.0 t-20 -21.14 -107.96 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.453 -179.377 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.548 ' C ' ' O ' ' A' ' 20' ' ' ASN . 4.6 mm100 -5.81 -73.88 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.245 -179.575 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.6 t -57.5 -68.61 0.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.478 179.923 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -48.38 -59.5 3.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.445 -179.69 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.422 179.583 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.636 ' O ' ' N ' ' A' ' 29' ' ' ASP . 22.4 m-20 -50.93 -60.53 2.98 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.29 179.751 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' C ' ' H ' ' A' ' 28' ' ' LEU . 75.2 m -53.1 -53.98 42.3 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.714 179.278 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 14.27 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.672 -179.832 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.735 ' C ' HD13 ' A' ' 28' ' ' LEU . 2.8 tm? -165.02 -52.19 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 119.876 -0.729 . . . . 0.0 112.613 -179.483 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.636 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -66.05 -15.72 63.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.574 0.226 . . . . 0.0 111.094 -179.06 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -134.31 13.16 3.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.733 0.301 . . . . 0.0 110.834 -179.973 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.4 m80 46.29 36.46 3.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.947 -179.955 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.4 -172.93 4.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.76 179.892 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 ttt-85 -95.96 -45.31 6.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.889 179.959 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 38.3 p -177.55 154.74 1.01 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.534 179.833 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.63 -164.87 16.34 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.125 -1.036 . . . . 0.0 113.254 -179.684 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -177.19 175.37 1.52 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.699 0.285 . . . . 0.0 110.448 -179.864 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.659 ' H ' HD23 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -88.19 149.49 23.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.135 0.493 . . . . 0.0 111.918 -179.834 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.412 ' CD1' ' O ' ' A' ' 37' ' ' CYS . 26.5 m-85 -148.91 145.68 27.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.168 179.388 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.501 ' O ' ' O ' ' A' ' 44' ' ' ASN . 17.0 m-85 -73.79 -102.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -179.522 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.463 ' CG ' ' O ' ' A' ' 39' ' ' TYR . 0.6 OUTLIER 48.97 -167.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.264 0.554 . . . . 0.0 111.086 -179.788 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER 27.64 63.17 0.1 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.307 -178.85 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.513 ' O ' ' N ' ' A' ' 44' ' ' ASN . 5.5 ttpt 69.68 65.95 0.25 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 178.655 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.475 ' HD3' ' H ' ' A' ' 43' ' ' ARG . 8.7 mmt85 32.76 33.51 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.558 178.986 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.513 ' N ' ' O ' ' A' ' 42' ' ' LYS . 10.5 m-20 -95.64 129.93 42.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 178.891 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -84.08 86.38 7.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.13 0.49 . . . . 0.0 110.988 -179.574 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -89.64 158.46 17.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.658 179.832 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.677 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 1.2 m -99.67 108.94 21.42 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.641 -179.506 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.2 mt -85.83 110.22 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.076 179.498 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 77.2 m -97.34 121.96 39.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.538 179.438 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.477 ' OD2' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -98.91 134.86 41.17 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.516 0.674 . . . . 0.0 110.859 179.791 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -121.0 66.41 0.86 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.28 -178.917 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.477 ' SG ' ' OD2' ' A' ' 50' ' ' ASP . 77.8 m -99.64 27.47 5.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.777 0.322 . . . . 0.0 111.457 -179.709 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.49 ' CG ' ' O ' ' A' ' 53' ' ' GLU . 5.4 pt-20 -80.98 112.65 18.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.356 179.306 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.533 ' CD1' ' C ' ' A' ' 54' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.863 -179.876 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . 0.457 ' O ' ' O ' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.446 -0.637 0 CA-C-O 120.814 0.34 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 1' ' ' PCA . 16.2 t0 -56.11 -151.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.195 -179.78 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -65.18 146.3 55.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.0 -179.923 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -124.15 -52.56 1.75 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.283 179.326 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.654 ' CD ' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -97.87 145.37 26.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.069 0.462 . . . . 0.0 111.039 179.904 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.3 mtpt -153.95 110.3 3.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.763 179.864 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 9' ' ' GLU . 1.0 OUTLIER -61.31 137.06 24.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.9 0.381 . . . . 0.0 111.656 -179.869 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.514 ' O ' ' C ' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -64.51 66.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.598 179.056 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 7' ' ' VAL . 12.6 mp0 17.21 -115.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.415 178.99 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.672 HD22 ' N ' ' A' ' 10' ' ' ASN . 1.3 m120 -50.34 -72.22 0.05 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.784 -179.816 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.663 ' CE2' ' SG ' ' A' ' 22' ' ' CYS . 2.4 t80 10.89 79.24 0.06 OUTLIER Pre-proline 0 N--CA 1.466 0.365 0 O-C-N 123.791 0.682 . . . . 0.0 112.147 -178.836 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -46.54 -53.35 6.16 Favored 'Trans proline' 0 CA--C 1.518 -0.304 0 C-N-CA 122.877 2.385 . . . . 0.0 112.524 -179.675 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.49 ' O ' ' C ' ' A' ' 14' ' ' SER . 1.2 t 173.58 -50.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.162 -0.927 . . . . 0.0 110.52 179.615 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.551 ' O ' ' CB ' ' A' ' 15' ' ' LYS . 5.5 p 23.05 55.23 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.875 -179.812 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.551 ' CB ' ' O ' ' A' ' 14' ' ' SER . 28.1 tptt 92.86 141.0 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.489 179.559 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 1.1 m -174.35 21.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.959 179.795 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.511 ' C ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER -101.03 44.65 1.0 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.342 0.592 . . . . 0.0 110.702 -179.783 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.9 mt -158.84 -129.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.449 179.744 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -178.43 46.66 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.531 -179.653 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.659 ' ND2' ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -141.33 -47.47 0.39 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.611 179.795 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.659 ' N ' ' ND2' ' A' ' 20' ' ' ASN . 5.7 tp60 -47.96 -80.22 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.835 179.904 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.663 ' SG ' ' CE2' ' A' ' 11' ' ' TYR . 22.5 m -62.48 -33.67 75.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.385 -179.902 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -53.46 -65.79 0.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.014 0.435 . . . . 0.0 109.87 179.29 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.569 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -55.05 -38.58 68.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.071 178.968 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 29' ' ' ASP . 25.2 m-20 -52.45 -63.45 1.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.397 179.622 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.433 ' C ' ' H ' ' A' ' 28' ' ' LEU . 36.8 m -55.27 -39.31 69.68 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.08 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -59.37 3.22 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.586 -179.6 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' A' ' 26' ' ' CYS . 36.1 tp -165.93 -33.2 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.508 -179.721 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.582 ' N ' ' O ' ' A' ' 25' ' ' ASP . 4.7 m-20 -65.83 -16.7 64.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.893 0.378 . . . . 0.0 110.487 -179.656 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.1 mtpm? -144.57 0.29 0.99 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.032 179.801 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m80 62.39 39.08 12.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.455 179.719 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.894 ' HB2' ' CZ ' ' A' ' 51' ' ' TYR . . . -86.81 -171.02 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.676 179.538 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.603 ' NE ' ' H ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -89.28 -39.0 13.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.768 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.479 ' OG ' ' N ' ' A' ' 35' ' ' GLY . 2.3 p -175.85 -147.33 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.294 179.666 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.479 ' N ' ' OG ' ' A' ' 34' ' ' SER . . . 149.24 173.48 19.9 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.555 -0.831 . . . . 0.0 113.36 179.952 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.45 ' CD ' ' O ' ' A' ' 35' ' ' GLY . 1.3 pm0 -175.11 172.41 2.81 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.683 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 145.64 25.61 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.663 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -145.15 149.34 34.82 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.35 179.551 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.604 ' CZ ' HD11 ' A' ' 45' ' ' LEU . 26.5 m-85 -80.54 150.44 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 111.355 -179.637 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 43' ' ' ARG . 24.8 p30 -99.12 -178.17 3.85 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.144 -179.863 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -63.01 -12.15 24.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.509 -179.477 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.9 mttm -94.92 -77.28 0.47 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.233 179.526 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.402 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 3.1 ptp180 175.45 1.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.329 -0.851 . . . . 0.0 112.161 179.482 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.502 HD22 ' N ' ' A' ' 44' ' ' ASN . 1.4 m-80 -93.97 151.64 19.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.068 0.461 . . . . 0.0 111.316 -179.366 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.675 ' N ' HD12 ' A' ' 45' ' ' LEU . 2.9 mp -91.02 153.9 19.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.201 -179.707 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -144.52 132.7 21.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.278 179.689 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.616 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 83.8 m -81.35 105.58 12.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 112.073 -179.005 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.1 mt -88.47 120.73 37.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.188 179.43 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 88.2 m -92.67 119.38 32.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.402 178.889 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.747 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 20.5 t0 -86.63 144.93 26.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.514 -179.303 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.894 ' CZ ' ' HB2' ' A' ' 32' ' ' ALA . 83.6 m-85 -138.84 42.15 2.13 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.36 -178.793 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.611 ' O ' ' N ' ' A' ' 54' ' ' TYR . 71.0 m -91.38 -84.65 0.25 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.666 -178.869 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.603 ' H ' ' NE ' ' A' ' 33' ' ' ARG . 8.3 tt0 14.27 -77.46 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.798 0.686 . . . . 0.0 111.881 179.961 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.611 ' N ' ' O ' ' A' ' 52' ' ' CYS . 9.3 m-85 . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.705 179.69 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . 0.428 ' C ' ' OD1' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.447 -0.579 0 CA-C-O 120.799 0.333 . . . . 0.0 111.336 . . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.428 ' OD1' ' C ' ' A' ' 1' ' ' PCA . 0.5 OUTLIER 37.88 -103.25 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.087 179.982 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.597 ' C ' ' H ' ' A' ' 5' ' ' LYS . 22.3 mmtm 59.73 172.32 0.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.97 0.414 . . . . 0.0 111.441 179.923 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 27.7 m 62.93 -24.87 0.06 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.966 179.948 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.597 ' H ' ' C ' ' A' ' 3' ' ' LYS . 10.2 mtpp -142.58 103.61 4.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.65 0.262 . . . . 0.0 110.465 179.859 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -142.05 131.67 24.01 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.219 0.533 . . . . 0.0 111.635 -179.502 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.781 HG23 ' H ' ' A' ' 9' ' ' GLU . 2.4 m -66.57 153.19 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.107 178.745 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.585 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 0.4 OUTLIER -81.81 36.3 0.44 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.086 0.47 . . . . 0.0 110.154 179.515 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.781 ' H ' HG23 ' A' ' 7' ' ' VAL . 2.3 pt-20 10.86 -100.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.946 179.066 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 11' ' ' TYR . 2.7 m120 -43.22 -72.45 0.06 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.501 -178.767 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.529 ' C ' ' O ' ' A' ' 10' ' ' ASN . 33.5 t80 16.57 102.12 0.02 OUTLIER Pre-proline 0 N--CA 1.469 0.508 0 O-C-N 123.471 0.482 . . . . 0.0 111.819 -178.93 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -42.6 93.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.319 2.012 . . . . 0.0 112.936 -179.568 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.9 t -56.2 96.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.9 p -178.57 23.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.119 179.633 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -174.45 107.71 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.378 -179.987 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -170.25 -10.58 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.156 -179.373 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -62.57 19.69 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -179.757 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.623 ' H ' ' C ' ' A' ' 16' ' ' CYS . 14.0 mt -164.73 134.32 3.73 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.741 0.305 . . . . 0.0 110.324 179.954 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.428 ' O ' ' CB ' ' A' ' 20' ' ' ASN . . . -56.16 -176.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 0.0 111.265 179.652 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' A' ' 24' ' ' TYR . 0.4 OUTLIER 81.9 -78.34 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.753 -179.828 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.49 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -29.15 -83.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.079 179.982 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.39 -46.07 91.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.061 0.458 . . . . 0.0 110.926 179.548 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.441 ' HA ' ' H ' ' A' ' 35' ' ' GLY . 0.1 OUTLIER -52.82 -75.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.22 -179.634 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.516 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER -47.43 -47.19 26.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.869 -179.947 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.583 ' O ' ' N ' ' A' ' 29' ' ' ASP . 88.7 m-20 -52.12 -73.64 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.575 -179.248 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 8' ' ' TYR . 0.8 OUTLIER -51.59 -38.29 53.82 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.913 -179.833 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.405 ' O ' ' CG ' ' A' ' 27' ' ' LYS . 64.9 tttt -63.15 7.18 0.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.964 179.392 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.478 ' H ' ' C ' ' A' ' 26' ' ' CYS . 5.8 tt -161.96 -22.29 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.859 -179.529 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -69.32 -55.59 10.01 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 179.025 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -101.17 3.44 41.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.134 179.312 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.9 m80 70.66 45.29 0.59 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.665 -179.547 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.49 -143.95 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.32 -179.717 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 50' ' ' ASP . 0.6 OUTLIER -142.54 -31.68 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.136 179.977 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 p -157.52 117.69 3.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.819 0.343 . . . . 0.0 111.876 -179.635 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.441 ' H ' ' HA ' ' A' ' 23' ' ' ASN . . . -104.6 71.86 0.25 Allowed Glycine 0 C--N 1.337 0.584 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.596 179.731 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -73.25 179.5 3.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.116 0.484 . . . . 0.0 111.816 -179.998 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -148.17 142.51 26.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.941 179.587 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -148.7 143.41 26.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -178.769 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.479 ' CD1' ' C ' ' A' ' 39' ' ' TYR . 0.0 OUTLIER -169.71 159.01 7.89 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.195 -1.366 . . . . 0.0 109.841 179.034 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -96.62 -82.51 0.4 Allowed 'General case' 0 CA--C 1.502 -0.87 0 CA-C-O 121.214 0.53 . . . . 0.0 111.91 -178.966 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.487 ' O ' ' OE1' ' A' ' 41' ' ' GLU . 0.3 OUTLIER -165.48 8.26 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.515 -179.657 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.414 ' O ' ' CB ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -98.12 2.93 49.1 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.768 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.414 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 0.7 OUTLIER 80.69 21.13 0.45 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.201 179.917 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -94.14 74.46 4.03 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-O 121.604 0.716 . . . . 0.0 109.845 179.001 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.2 tp -97.81 139.1 34.18 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.517 -1.22 . . . . 0.0 112.6 -178.09 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -141.85 144.89 34.1 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.022 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.649 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -97.38 110.1 22.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.808 -179.835 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -87.71 112.21 23.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-O 120.821 0.343 . . . . 0.0 111.215 179.774 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 81.2 m -105.85 104.37 14.07 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.291 179.929 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.472 ' O ' ' N ' ' A' ' 33' ' ' ARG . 4.3 t70 -96.16 136.18 36.97 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.008 179.275 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -101.84 -24.45 14.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.7 -178.548 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.603 ' O ' ' CG ' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -137.81 -82.99 0.33 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.136 179.803 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.603 ' CG ' ' O ' ' A' ' 52' ' ' CYS . 0.3 OUTLIER 119.63 27.2 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.717 0 O-C-N 124.534 1.147 . . . . 0.0 110.292 179.854 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 53' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.498 179.783 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.593 0 CA-C-O 120.785 0.326 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -100.73 169.97 8.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.927 -179.983 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.13 -168.8 2.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.579 179.91 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.3 m -116.03 -45.73 2.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.362 -179.633 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 pptp? -97.07 146.16 25.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.487 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 mtpm? -150.33 121.34 7.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.994 0.426 . . . . 0.0 111.376 -179.942 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.428 ' H ' HG13 ' A' ' 7' ' ' VAL . 1.0 OUTLIER -66.04 151.3 10.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.902 179.407 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.555 ' O ' ' N ' ' A' ' 10' ' ' ASN . 0.6 OUTLIER -83.88 81.88 8.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.687 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.579 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 17.0 pt-20 -61.61 72.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.616 -179.495 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.579 ' CB ' ' O ' ' A' ' 9' ' ' GLU . 31.4 t30 127.04 101.26 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.511 1.132 . . . . 0.0 110.527 -179.871 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -179.3 134.15 0.28 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.61 ' O ' ' N ' ' A' ' 14' ' ' SER . 89.0 Cg_endo -79.58 122.54 5.05 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.171 1.914 . . . . 0.0 112.553 -179.972 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.6 t -61.16 43.4 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.243 179.606 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.61 ' N ' ' O ' ' A' ' 12' ' ' PRO . 10.1 p -62.6 -110.36 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.952 0.406 . . . . 0.0 111.434 -179.502 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -67.59 23.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.41 -179.633 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.0 OUTLIER -66.04 -26.06 67.34 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.751 179.736 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -67.38 12.67 0.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.973 -179.806 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.53 ' H ' ' C ' ' A' ' 16' ' ' CYS . 16.8 mt -162.89 124.34 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.426 -179.862 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.04 107.37 0.35 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.48 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.4 OUTLIER -174.56 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.267 179.998 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' A' ' 25' ' ' ASP . 0.0 OUTLIER -46.13 -64.66 0.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.355 -179.652 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 t -56.11 -53.52 56.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.274 -179.545 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -51.68 -72.59 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.931 -179.845 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.547 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -47.81 -44.57 28.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.437 ' CG ' ' O ' ' A' ' 21' ' ' GLN . 7.2 m-20 -55.51 -74.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.498 -179.542 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.508 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 0.5 OUTLIER -52.17 -34.09 43.49 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.164 -179.658 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -59.21 1.32 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.263 179.34 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.493 ' H ' ' C ' ' A' ' 26' ' ' CYS . 57.9 tp -162.92 -29.82 0.04 OUTLIER 'General case' 0 C--O 1.232 0.165 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.991 -179.728 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.06 -48.58 57.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.765 0.317 . . . . 0.0 110.692 179.846 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -100.2 18.03 19.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.938 -179.918 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.1 m170 55.43 44.74 26.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 -179.727 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 26' ' ' CYS . . . -87.4 -160.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.493 -179.732 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.507 ' NE ' ' O ' ' A' ' 51' ' ' TYR . 40.4 ttm-85 -139.01 -27.3 0.82 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.53 -179.856 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 1.5 p -178.64 120.18 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.126 179.712 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -118.91 179.37 16.79 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.363 -179.271 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -178.71 145.71 0.31 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -179.65 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 3.7 m -87.93 131.37 34.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.833 0.349 . . . . 0.0 111.181 -179.675 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.438 ' O ' HD12 ' A' ' 45' ' ' LEU . 51.3 m-85 -146.7 171.35 15.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.303 -179.653 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -86.13 134.53 33.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.225 179.318 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 42' ' ' LYS . 2.4 p-10 -142.07 -83.23 0.19 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.19 0.519 . . . . 0.0 112.165 -179.101 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.576 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.1 OUTLIER -59.72 70.47 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.221 -178.095 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 40' ' ' ASP . 8.4 mptt 53.81 85.07 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.536 179.252 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.652 ' H ' ' HE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER 57.92 18.49 5.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.756 179.109 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.576 ' ND2' ' O ' ' A' ' 41' ' ' GLU . 1.9 m-80 -93.8 115.75 28.18 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 179.327 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.438 HD12 ' O ' ' A' ' 38' ' ' PHE . 21.2 tp -82.75 93.07 7.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.951 0.405 . . . . 0.0 111.407 -179.026 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -100.94 -178.92 3.9 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.39 179.87 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.628 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -104.79 104.07 13.79 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.491 -179.568 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.821 HD12 ' N ' ' A' ' 48' ' ' ILE . 1.0 OUTLIER -88.65 109.53 20.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.511 179.305 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.0 m -96.95 119.18 34.94 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.774 0.321 . . . . 0.0 111.267 -179.709 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.503 ' CB ' ' O ' ' A' ' 34' ' ' SER . 2.2 t0 -94.48 137.08 34.05 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.185 0.517 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.507 ' O ' ' NE ' ' A' ' 33' ' ' ARG . 5.6 m-85 -103.61 -17.89 14.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.46 179.996 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 29.0 m -113.49 -116.42 0.32 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.972 -179.59 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 169.26 -58.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.775 -179.99 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.813 -179.882 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.584 0 CA-C-O 120.801 0.334 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -84.46 -101.89 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.977 -179.95 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 36.9 mttm -48.05 160.65 0.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.144 -179.751 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.13 -8.44 2.3 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.558 179.726 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.41 ' O ' ' CE ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -147.08 145.55 29.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.998 179.972 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HZ1' ' CD ' ' A' ' 9' ' ' GLU . 8.3 tttp -146.73 116.86 7.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.128 0.49 . . . . 0.0 110.861 -179.777 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -63.25 142.75 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.456 -179.573 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.563 ' C ' ' H ' ' A' ' 10' ' ' ASN . 0.2 OUTLIER -62.78 110.95 1.91 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.833 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.455 ' C ' ' OD1' ' A' ' 10' ' ' ASN . 26.7 mt-10 -60.65 5.86 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.398 -178.674 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.563 ' H ' ' C ' ' A' ' 8' ' ' TYR . 1.8 p-10 172.2 122.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.8 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.627 ' O ' ' N ' ' A' ' 13' ' ' VAL . 19.8 t80 -179.72 123.54 0.23 Allowed Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.089 179.955 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.14 76.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.397 2.065 . . . . 0.0 113.138 -179.634 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.627 ' N ' ' O ' ' A' ' 11' ' ' TYR . 1.4 p -58.68 97.15 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.144 0.497 . . . . 0.0 110.981 179.849 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.533 ' C ' ' H ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -178.0 -57.78 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.778 -179.867 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.553 ' C ' ' H ' ' A' ' 17' ' ' GLN . 13.7 tttp -67.21 10.25 0.17 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.666 179.987 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.533 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -67.61 19.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.233 -179.921 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.688 ' C ' HD12 ' A' ' 18' ' ' LEU . 0.4 OUTLIER -88.33 56.32 3.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.116 0.484 . . . . 0.0 110.875 -179.682 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.688 HD12 ' C ' ' A' ' 17' ' ' GLN . 5.5 mp -161.92 -122.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.671 179.737 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' LEU . . . 174.01 28.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.548 -179.688 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 21' ' ' GLN . 29.1 t-20 -131.19 -52.85 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.486 179.961 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.42 ' C ' ' O ' ' A' ' 20' ' ' ASN . 8.2 mm-40 -37.19 -86.87 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.916 -179.764 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.585 ' SG ' ' CD2' ' A' ' 11' ' ' TYR . 1.8 m -59.87 -37.33 79.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.536 0.208 . . . . 0.0 111.326 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.485 ' OD1' ' O ' ' A' ' 35' ' ' GLY . 13.5 t-20 -56.28 -75.79 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.68 0.276 . . . . 0.0 110.954 179.788 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.512 ' C ' ' CD1' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -48.86 -43.57 38.93 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.906 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.509 ' O ' ' N ' ' A' ' 29' ' ' ASP . 10.7 m-20 -51.89 -57.36 9.61 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.684 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 96.3 m -53.62 -44.55 69.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.406 0.622 . . . . 0.0 109.464 178.801 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -62.51 7.51 0.07 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 113.165 -178.78 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.87 -37.65 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.933 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.509 ' N ' ' O ' ' A' ' 25' ' ' ASP . 1.0 OUTLIER -66.79 -12.55 59.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.769 0.319 . . . . 0.0 111.081 -179.259 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.9 mttm -144.63 10.91 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.082 179.768 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 4.7 m80 54.9 46.8 23.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.555 -179.883 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -87.6 -174.19 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.382 -179.664 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.401 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 0.9 OUTLIER -96.66 -59.63 1.77 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.229 179.586 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.449 ' O ' ' CB ' ' A' ' 50' ' ' ASP . 3.9 p -158.05 114.05 2.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.694 179.991 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.485 ' O ' ' OD1' ' A' ' 23' ' ' ASN . . . -105.62 164.26 13.99 Favored Glycine 0 C--N 1.33 0.196 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.142 -179.618 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -176.43 167.66 2.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.982 0.42 . . . . 0.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 4.4 m -89.29 130.01 35.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.278 -179.716 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -148.22 161.98 40.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.955 179.898 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.58 ' O ' ' N ' ' A' ' 41' ' ' GLU . 75.4 m-85 -91.2 115.28 27.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.816 179.799 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.492 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 6.8 p-10 -57.11 77.12 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 121.51 0.671 . . . . 0.0 110.492 179.854 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 39' ' ' TYR . 34.4 mt-10 27.87 40.57 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.688 -1.142 . . . . 0.0 112.177 -179.724 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -142.23 -81.83 0.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.099 178.807 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 42' ' ' LYS . 10.1 mtp180 160.74 23.73 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.97 179.789 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.474 ' C ' ' OE1' ' A' ' 46' ' ' GLN . 98.9 m-20 -97.65 -13.61 21.42 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.591 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.514 HD13 ' CZ ' ' A' ' 39' ' ' TYR . 5.9 tp 57.68 122.19 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.644 0.259 . . . . 0.0 111.15 -179.665 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.474 ' OE1' ' C ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -149.54 -179.14 6.86 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.96 0.41 . . . . 0.0 110.423 179.107 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.524 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 36.3 m -102.07 139.14 38.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 14.5 mt -139.4 121.21 16.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 0.0 112.052 -178.884 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 m -92.63 124.11 36.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.018 178.468 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' A' ' 34' ' ' SER . 9.0 t70 -88.49 124.38 33.93 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.126 0.489 . . . . 0.0 111.192 -179.319 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -115.18 50.2 1.0 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.311 -179.383 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 69.4 m -87.75 28.24 1.04 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.542 179.916 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' A' ' 54' ' ' TYR . 5.4 tm-20 -49.86 122.01 6.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.607 179.549 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.463 ' O ' ' OE1' ' A' ' 53' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.335 -0.84 . . . . 0.0 110.852 -179.724 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . 0.464 ' C ' ' H ' ' A' ' 3' ' ' LYS . . . . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 120.937 0.399 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.483 ' O ' ' CB ' ' A' ' 3' ' ' LYS . 4.5 t70 73.76 -14.44 0.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.694 -179.683 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.483 ' CB ' ' O ' ' A' ' 2' ' ' ASP . 0.0 OUTLIER 84.08 86.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.068 179.844 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 68.6 m 53.22 39.18 29.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.105 179.752 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.4 135.5 26.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.436 179.924 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -149.79 121.87 8.29 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.913 0.387 . . . . 0.0 111.285 179.829 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 m -61.85 161.98 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.179 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.233 179.782 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.424 ' CD1' ' HB2' ' A' ' 11' ' ' TYR . 0.2 OUTLIER -113.15 84.49 2.01 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.473 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -57.94 -79.62 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.146 -178.174 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.604 ' H ' ' CD ' ' A' ' 9' ' ' GLU . 6.9 t-20 -38.96 -38.88 0.48 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.696 -178.416 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' HB2' ' CD1' ' A' ' 8' ' ' TYR . 53.0 t80 -52.87 124.84 37.56 Favored Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.585 -178.939 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.562 ' C ' ' H ' ' A' ' 14' ' ' SER . 73.0 Cg_exo -46.35 112.32 0.45 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 122.148 1.898 . . . . 0.0 112.579 179.567 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 1.3 p -60.59 7.52 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.477 179.598 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.562 ' H ' ' C ' ' A' ' 12' ' ' PRO . 5.1 p -60.66 -108.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.558 -179.252 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.3 ttpm? -63.44 149.74 45.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.886 -179.527 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 47' ' ' CYS . 0.1 OUTLIER -171.94 3.92 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.608 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.537 HE21 ' CA ' ' A' ' 17' ' ' GLN . 0.1 OUTLIER -86.62 -32.24 20.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.978 -179.892 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.576 ' C ' ' H ' ' A' ' 20' ' ' ASN . 1.3 mm? -68.86 116.26 9.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.726 -179.415 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.19 39.06 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.076 179.161 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.576 ' H ' ' C ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -136.71 -108.04 0.2 Allowed 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.941 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.555 ' C ' ' O ' ' A' ' 20' ' ' ASN . 0.0 OUTLIER 0.9 -80.59 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.069 0.547 . . . . 0.0 112.439 179.182 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 36.0 t -58.01 -58.07 10.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.889 179.848 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.531 ' N ' ' O ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -52.83 -56.96 11.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.459 179.957 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -53.14 -52.52 58.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.352 179.46 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.633 ' O ' ' N ' ' A' ' 29' ' ' ASP . 2.8 m-20 -50.99 -50.16 58.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.29 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.496 ' C ' ' H ' ' A' ' 28' ' ' LEU . 1.2 m -51.83 -54.26 30.96 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.447 0.641 . . . . 0.0 109.331 178.696 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -61.25 14.75 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.683 -179.806 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.54 ' O ' HD13 ' A' ' 28' ' ' LEU . 0.9 OUTLIER -167.2 -53.63 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.378 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.633 ' N ' ' O ' ' A' ' 25' ' ' ASP . 0.9 OUTLIER -65.81 -13.26 59.15 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.569 0.223 . . . . 0.0 111.483 -178.884 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 31' ' ' HIS . 3.0 mmmp? -139.79 24.02 2.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.009 0.433 . . . . 0.0 110.776 179.875 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.441 ' C ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER 34.0 38.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.089 179.636 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -86.76 179.99 6.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.909 0.385 . . . . 0.0 110.937 179.923 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 mmm-85 -92.27 -27.19 17.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.266 0.555 . . . . 0.0 109.837 179.724 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.6 p 178.37 -168.09 0.07 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.836 179.629 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 175.41 -177.16 47.36 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 119.838 -1.173 . . . . 0.0 113.352 179.975 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -178.45 -154.42 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -179.836 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.94 142.86 30.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.733 0.301 . . . . 0.0 110.574 179.493 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.492 ' O ' HD12 ' A' ' 45' ' ' LEU . 66.5 m-85 -146.88 164.41 32.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.124 0.487 . . . . 0.0 111.585 -179.41 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.405 ' CE2' HD13 ' A' ' 45' ' ' LEU . 22.2 m-85 -101.59 119.3 38.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.078 -179.8 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.591 ' C ' ' H ' ' A' ' 42' ' ' LYS . 11.4 p-10 -51.75 168.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.623 179.703 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -64.22 36.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.968 0.414 . . . . 0.0 111.495 -179.835 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.591 ' H ' ' C ' ' A' ' 40' ' ' ASP . 3.6 mmtp -146.86 -81.25 0.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.171 179.625 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 13.3 tpp85 -176.82 20.7 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.112 179.677 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -100.78 124.66 46.75 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.65 179.527 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 38' ' ' PHE . 51.6 tp -89.51 138.48 31.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.389 179.424 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -147.61 145.8 29.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.953 0.406 . . . . 0.0 111.63 -179.459 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.651 ' SG ' ' SG ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER -82.67 109.02 16.48 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.929 -179.96 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.9 mt -90.3 116.88 32.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.912 0.387 . . . . 0.0 111.86 -179.925 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.47 120.1 36.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.685 179.412 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.28 136.28 34.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.958 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -111.16 -6.34 14.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.598 -179.29 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.7 m -143.48 -113.65 0.11 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.035 0.445 . . . . 0.0 111.822 -179.294 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 67.8 127.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.855 -179.372 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.643 179.868 . . . . . . . . 0 0 . 1 stop_ save_