data_1f43_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 1f43 _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 ' 9' ' ' SER . . . . . 0.632 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.632 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.54 -22.87 13.46 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.565 1.51 . . . . 0.0 110.916 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 15' ' ' PHE . 26.7 mt-30 -49.36 -25.16 2.27 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.929 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.24 -56.08 5.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.228 0.537 . . . . 0.0 109.91 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.69 -36.19 28.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.679 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -65.73 -55.79 15.49 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.499 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.524 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -55.3 -52.4 63.56 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.491 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.487 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.6 tp -63.88 -34.25 77.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.987 178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.553 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -52.38 -65.01 0.63 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.316 179.584 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -60.73 -32.27 71.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.833 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.49 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 89.1 t -59.03 -67.26 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.466 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 28.8 t80 -60.85 -17.53 50.69 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.981 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.553 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.67 -38.22 54.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.88 0.372 . . . . 0.0 110.68 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -59.27 -38.92 81.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.443 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.479 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -170.16 -147.57 0.06 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.804 179.805 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.479 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.8 mm-40 -140.41 -51.96 0.48 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.179 0.514 . . . . 0.0 110.983 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.5 t -77.6 70.88 4.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.332 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.456 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.9 mt -74.08 106.38 5.73 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.401 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 4.0 p30 -87.48 178.19 6.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.824 0.345 . . . . 0.0 111.658 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.4 m -48.07 -29.29 3.43 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.445 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.421 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.7 mmpt? -77.63 -47.5 19.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.526 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 22.6 mt-10 -73.03 -35.73 66.81 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.945 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 3.1 pttt -61.45 -33.87 74.46 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.029 0.442 . . . . 0.0 109.908 179.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -90.49 -36.49 14.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.421 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.1 mm-40 -74.67 -35.57 62.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.526 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 81.9 t -78.96 -37.88 20.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.3 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.631 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -64.81 -30.19 71.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.098 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -87.34 -21.06 25.92 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.439 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.6 OUTLIER -103.51 -28.91 11.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.636 0.255 . . . . 0.0 111.428 -179.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 78.9 m -92.71 -27.84 17.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.289 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.92 24.29 4.95 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.377 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.631 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.97 -163.91 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.025 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.41 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -150.27 156.5 37.29 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.761 0.315 . . . . 0.0 111.148 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.431 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 75.1 Cg_exo -49.65 -24.9 10.27 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.687 2.258 . . . . 0.0 112.292 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.2 OUTLIER -90.0 -27.71 19.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.608 179.775 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.521 ' O ' ' N ' ' A' ' 48' ' ' TRP . 33.0 mm-40 -82.57 -58.27 2.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.843 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.539 HG11 ' HB3' ' A' ' 35' ' ' ALA . 24.9 m -36.67 -32.61 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.282 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.506 ' O ' HG12 ' A' ' 50' ' ' ILE . 1.1 ptp85 -82.37 -60.57 2.16 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.76 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 44' ' ' GLN . 17.2 m -67.87 -44.58 85.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.329 0.585 . . . . 0.0 111.33 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.521 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -60.85 -52.83 63.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.797 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.536 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 18.2 m-30 -64.85 -28.0 69.26 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.714 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.8 mm -53.89 -51.67 42.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.66 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -80.13 -30.65 39.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.695 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.43 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 14.6 mmtt -94.94 18.78 11.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.103 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 49' ' ' PHE . 3.6 ttm105 -179.84 33.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.077 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.4 ttt . . . . . 0 C--N 1.332 -0.191 0 CA-C-O 120.882 0.373 . . . . 0.0 110.851 -179.93 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.647 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.647 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.87 -24.45 13.67 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 121.643 1.562 . . . . 0.0 110.964 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.55 ' O ' ' N ' ' A' ' 15' ' ' PHE . 29.2 mt-30 -47.63 -27.36 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.699 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.38 -55.85 3.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.184 0.516 . . . . 0.0 110.038 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.66 -36.44 28.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 178.843 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.06 -56.01 15.52 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.643 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.55 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -56.11 -50.71 70.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.562 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.471 ' N ' ' CG ' ' A' ' 15' ' ' PHE . 2.1 tp -65.5 -31.71 72.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.918 178.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.454 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 4.0 mt-10 -56.33 -56.15 24.68 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.393 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.436 ' HA ' ' HD3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.48 -24.39 62.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.997 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.474 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 89.5 t -73.08 -64.22 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.01 0.433 . . . . 0.0 110.951 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.438 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 21.4 t80 -61.82 -17.67 57.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.902 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 1.0 OUTLIER -79.53 -38.49 34.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.518 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -59.27 -38.55 80.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.0 ptmt -169.95 -145.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.564 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.518 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 21.5 mm-40 -144.59 -50.04 0.27 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.997 0.427 . . . . 0.0 111.412 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -81.82 71.88 8.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.417 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.49 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 1.5 mt -73.3 108.94 6.46 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -85.03 176.38 8.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.757 0.313 . . . . 0.0 111.06 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.5 m -45.9 -29.96 1.57 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.417 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.1 mmpt? -77.65 -48.74 16.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.842 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.504 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 15.5 mt-10 -70.79 -38.82 73.37 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.892 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.528 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 2.6 pttt -59.58 -34.33 72.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.017 0.436 . . . . 0.0 110.127 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -90.66 -37.42 13.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.633 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -73.51 -34.53 65.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.553 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 89.5 t -80.74 -38.8 17.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.402 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.605 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -63.4 -31.13 72.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.916 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -87.58 -19.95 27.11 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.02 -24.87 12.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.643 0.259 . . . . 0.0 111.551 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.0 m -97.5 -26.67 14.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.291 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.87 25.41 4.53 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.407 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.605 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -112.55 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.085 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.94 157.15 40.61 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.401 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 78.4 Cg_exo -50.41 -24.53 12.28 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.663 2.242 . . . . 0.0 112.269 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.435 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.3 tp -89.9 -28.13 19.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.731 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.532 ' O ' ' N ' ' A' ' 48' ' ' TRP . 35.8 mm-40 -81.5 -57.98 3.23 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.126 0.488 . . . . 0.0 109.823 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.542 HG12 ' HB1' ' A' ' 35' ' ' ALA . 19.7 m -36.32 -32.82 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.615 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.481 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -83.78 -57.98 2.99 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.8 179.665 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.463 HG21 ' HA ' ' A' ' 44' ' ' GLN . 21.6 m -68.66 -43.55 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 111.218 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.532 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -62.66 -53.91 47.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.018 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.5 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 19.1 m-30 -64.36 -28.9 70.01 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.427 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.2 -52.87 26.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.913 0.387 . . . . 0.0 110.599 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -79.0 -30.59 44.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.638 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.452 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 49.7 mmtt -93.89 19.19 9.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.924 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 29.2 ttp180 -177.5 31.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.976 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.2 0 CA-C-O 120.902 0.382 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.668 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.303 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.668 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.9 Cg_endo -51.95 -23.29 16.25 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.759 1.639 . . . . 0.0 111.177 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.47 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -51.2 -23.44 3.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.137 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.69 -57.05 6.0 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.2 0.524 . . . . 0.0 109.852 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -80.99 -34.66 32.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.554 178.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.16 -56.47 12.7 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.239 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.522 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -53.03 -51.16 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.903 179.595 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.463 ' N ' ' CG ' ' A' ' 15' ' ' PHE . 1.6 tp -68.53 -31.77 71.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.309 178.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.661 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.0 mt-10 -52.47 -57.72 8.99 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.318 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.77 -35.99 77.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.899 179.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.484 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 86.6 t -58.52 -64.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-O 120.911 0.386 . . . . 0.0 110.137 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.412 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 63.2 t80 -60.72 -16.19 37.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.169 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.661 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -78.9 -39.21 35.57 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 110.805 179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.5 mtp85 -59.54 -40.34 86.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.884 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.488 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -163.33 -147.87 0.12 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.935 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.412 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 30.2 mm-40 -139.05 -49.43 0.51 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.436 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -99.19 91.17 4.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.067 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.503 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 1.8 mt -78.91 136.74 37.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.101 178.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.72 175.8 6.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.243 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.1 m -51.54 -26.12 7.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.467 . . . . 0.0 110.878 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.426 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -80.01 -47.5 14.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.582 179.673 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.499 ' O ' ' N ' ' A' ' 34' ' ' VAL . 2.9 mm-40 -71.63 -37.73 70.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.633 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.549 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 11.9 pttm -60.29 -35.77 76.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.77 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -89.0 -36.17 15.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.701 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.426 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 8.8 mm-40 -75.18 -36.09 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.728 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.499 ' N ' ' O ' ' A' ' 30' ' ' GLU . 82.1 t -78.24 -39.37 24.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.01 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.628 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -63.09 -30.41 71.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.98 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -87.58 -20.52 26.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 20.2 ptmt -105.07 -26.08 12.26 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.466 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -94.79 -28.2 15.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.101 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.09 23.57 4.85 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.309 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.628 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.78 -162.59 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.113 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.43 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -151.8 153.95 32.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.858 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.408 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 85.7 Cg_exo -47.28 -26.31 5.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.713 2.275 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 8.8 tp -88.05 -28.56 21.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.658 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' TRP . 34.8 mm-40 -81.74 -58.14 3.13 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.068 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.531 HG11 ' HB1' ' A' ' 35' ' ' ALA . 21.3 m -36.27 -33.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.395 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.499 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -82.05 -58.75 2.83 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.792 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.477 HG22 ' HA ' ' A' ' 44' ' ' GLN . 24.3 m -67.82 -43.66 86.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.271 0.558 . . . . 0.0 111.278 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.77 -54.23 45.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.018 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.518 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 19.8 m-30 -63.7 -29.34 70.58 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 120.674 0.273 . . . . 0.0 110.6 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.4 mm -52.28 -56.06 8.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.747 0.308 . . . . 0.0 110.912 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -77.76 -31.16 51.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.427 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 52.8 mmtt -90.11 11.63 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.133 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' A' ' 49' ' ' PHE . 9.5 ttp180 -170.57 32.35 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.165 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.965 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.648 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.271 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.648 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.37 -23.9 14.87 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.684 1.589 . . . . 0.0 110.985 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.561 ' O ' ' N ' ' A' ' 15' ' ' PHE . 27.8 mt-30 -49.35 -26.62 3.28 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.832 179.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.08 -55.84 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.338 0.59 . . . . 0.0 110.038 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.402 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -81.49 -36.56 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.612 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -65.7 -57.53 7.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.581 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.561 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -54.31 -52.02 62.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.005 179.72 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.463 ' N ' ' CG ' ' A' ' 15' ' ' PHE . 2.0 tp -64.95 -34.58 78.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.568 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.32 -64.12 0.91 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.362 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -62.75 -34.54 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.974 179.699 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.489 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 74.9 t -58.58 -65.5 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-O 120.816 0.341 . . . . 0.0 110.137 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -61.34 -15.54 36.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.21 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.94 -36.27 28.19 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 120.899 0.38 . . . . 0.0 111.063 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -58.87 -37.87 77.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.587 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.451 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.0 ptmt -163.19 -138.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.331 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.441 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 19.5 mm-40 -147.9 -46.5 0.16 Allowed 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.516 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.1 t -100.36 82.92 2.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.496 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 5.0 mt -74.95 125.04 28.04 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 176.31 6.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.749 0.309 . . . . 0.0 110.951 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.1 t -45.88 -29.82 1.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.142 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.0 mmpt? -78.19 -48.06 16.7 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.515 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' A' ' 34' ' ' VAL . 3.7 mt-10 -70.1 -40.15 75.11 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 7.3 pttt -58.76 -34.63 71.62 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.16 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.08 -37.01 14.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.678 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -73.88 -34.71 64.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.583 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.513 ' N ' ' O ' ' A' ' 30' ' ' GLU . 82.4 t -80.29 -38.07 17.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.327 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.591 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -65.31 -30.9 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.935 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -87.61 -19.22 28.08 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -25.27 13.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 0.0 111.574 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 56.9 m -96.99 -30.22 13.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.064 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.04 22.58 4.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.208 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.591 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -107.05 -163.26 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.98 155.54 37.81 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.674 0.273 . . . . 0.0 111.081 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.415 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 73.5 Cg_exo -48.79 -29.41 14.77 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.499 2.133 . . . . 0.0 112.037 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.434 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 22.5 tp -84.32 -26.93 28.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.683 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.497 ' O ' ' N ' ' A' ' 48' ' ' TRP . 5.6 mm-40 -83.35 -59.19 2.54 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.562 HG11 ' HB3' ' A' ' 35' ' ' ALA . 19.6 m -36.25 -33.89 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.112 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.513 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -80.68 -58.77 2.95 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.934 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.47 HG23 ' HA ' ' A' ' 44' ' ' GLN . 21.9 m -69.0 -44.28 81.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.361 0.6 . . . . 0.0 111.344 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.497 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.45 -52.8 63.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.023 -179.424 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.513 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 21.6 m-30 -66.79 -24.76 66.23 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.715 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.513 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -55.51 -53.95 30.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.872 0.368 . . . . 0.0 110.369 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -80.83 -30.09 35.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.626 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.447 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 63.3 mmtt -93.23 14.94 16.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.021 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.513 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 6.5 ttp180 -178.14 36.37 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.167 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-O 121.051 0.453 . . . . 0.0 110.299 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.65 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.65 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.1 Cg_endo -51.73 -23.08 14.72 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.678 1.585 . . . . 0.0 110.999 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.554 ' O ' ' N ' ' A' ' 15' ' ' PHE . 27.9 mt-30 -49.85 -25.31 3.03 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.865 179.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.4 -56.23 4.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.313 0.578 . . . . 0.0 109.877 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 2.6 ptt85 -81.37 -37.64 27.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.564 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.57 -56.83 12.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.554 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -54.03 -51.45 63.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.033 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.478 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.8 tp -64.46 -34.18 77.61 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.562 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.4 -67.08 0.28 Allowed 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.148 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -35.69 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.073 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.458 HG13 ' CZ ' ' A' ' 49' ' ' PHE . 71.8 t -56.14 -67.73 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.932 0.396 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.41 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 46.7 t80 -61.26 -15.93 40.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.372 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.562 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.07 -37.75 28.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.861 0.363 . . . . 0.0 111.005 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.9 mtp-105 -59.99 -37.52 79.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.637 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.429 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.48 -150.35 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.318 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.41 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 32.0 mm-40 -141.68 -46.48 0.36 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.987 0.423 . . . . 0.0 111.489 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.1 t -84.55 77.85 9.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.244 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.479 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 2.0 mt -80.67 109.86 15.62 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -97.49 -176.12 3.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.301 . . . . 0.0 111.317 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.436 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.5 m -48.55 -30.9 5.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.42 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.4 mmpt? -77.0 -48.49 17.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.685 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.0 mm-40 -70.69 -39.15 73.66 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.984 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 34.6 pttt -58.44 -34.44 70.83 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.089 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -91.82 -36.69 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.736 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.428 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -74.21 -35.38 63.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.646 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.509 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 91.0 t -79.97 -39.86 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.598 ' HB1' HG11 ' A' ' 45' ' ' VAL . . . -62.75 -30.04 71.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.099 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.41 -19.82 27.54 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.422 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -106.69 -21.74 12.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.632 0.253 . . . . 0.0 111.518 -179.467 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 71.6 m -99.31 -26.62 14.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.259 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.57 26.25 4.58 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.329 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.588 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -112.57 -167.92 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.262 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.04 155.68 62.11 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 111.076 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.26 -25.13 12.81 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.616 2.211 . . . . 0.0 112.28 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -89.22 -26.28 21.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.626 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.535 ' O ' ' N ' ' A' ' 48' ' ' TRP . 29.4 mm-40 -82.26 -58.83 2.77 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.598 HG11 ' HB1' ' A' ' 35' ' ' ALA . 19.3 m -36.62 -33.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.404 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.498 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.43 -59.48 2.61 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.681 179.576 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.43 ' CG2' ' N ' ' A' ' 48' ' ' TRP . 20.4 m -69.21 -44.32 80.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.285 0.565 . . . . 0.0 111.379 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.535 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.43 -51.99 66.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.065 -179.447 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.512 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 20.7 m-30 -67.05 -27.3 67.28 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.674 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.44 -53.88 21.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.584 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -79.92 -29.52 39.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.432 ' HG3' HD12 ' A' ' 16' ' ' LEU . 63.5 mmtt -93.57 17.41 11.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 49' ' ' PHE . 22.7 ttp180 -178.18 32.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.193 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.4 ttm . . . . . 0 C--N 1.331 -0.198 0 CA-C-O 120.931 0.396 . . . . 0.0 111.069 -179.89 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.9 Cg_endo -49.8 -24.04 9.47 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.692 1.595 . . . . 0.0 110.998 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.565 ' O ' ' N ' ' A' ' 15' ' ' PHE . 28.4 mt-30 -46.46 -27.62 1.14 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.91 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.25 -57.06 3.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 110.074 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.413 ' O ' ' N ' ' A' ' 17' ' ' GLU . 1.2 ptm180 -81.13 -35.43 31.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.771 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -65.8 -56.59 11.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 120.985 0.421 . . . . 0.0 111.145 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.565 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -52.63 -50.09 63.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.879 179.353 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.535 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -67.93 -36.21 79.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.801 178.825 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.615 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.7 mt-10 -48.21 -60.54 2.56 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.157 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -65.11 -35.01 79.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.264 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.477 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 87.8 t -58.12 -65.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 110.035 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.428 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 19.3 t80 -60.72 -17.83 50.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.949 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.615 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.8 -38.87 53.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.952 0.405 . . . . 0.0 110.84 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.38 -41.79 90.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.644 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -164.23 -144.59 0.08 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.631 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.518 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 20.2 mm-40 -145.45 -48.47 0.23 Allowed 'General case' 0 C--N 1.334 -0.081 0 CA-C-O 120.881 0.372 . . . . 0.0 111.563 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.3 t -86.01 73.36 10.31 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.487 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 2.3 mt -73.16 113.45 10.23 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -88.2 178.13 6.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.736 0.303 . . . . 0.0 110.99 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -47.44 -28.68 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.001 0.429 . . . . 0.0 111.045 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.0 OUTLIER -77.1 -50.62 12.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.914 179.883 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.508 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 8.7 mt-10 -70.56 -38.9 74.19 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.82 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.543 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 19.7 pttt -59.05 -34.89 72.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.151 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -90.5 -37.6 13.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.699 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.04 -34.28 66.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.633 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.508 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 92.7 t -81.75 -38.66 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.629 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.63 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -62.73 -33.72 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.992 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.8 pttm -87.58 -18.83 28.81 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -25.67 13.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.667 0.27 . . . . 0.0 111.44 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 76.8 m -98.51 -29.57 13.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.138 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.28 22.96 3.97 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.415 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.63 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -110.08 -163.77 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 179.12 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.408 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -148.98 154.45 39.69 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.788 0.328 . . . . 0.0 110.984 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -47.98 -27.61 9.08 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.61 2.206 . . . . 0.0 112.289 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.442 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.1 tp -85.83 -28.3 24.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.693 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.536 ' O ' ' N ' ' A' ' 48' ' ' TRP . 37.5 mm-40 -82.06 -58.84 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.899 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.535 HG12 ' HB1' ' A' ' 35' ' ' ALA . 20.9 m -35.94 -33.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.375 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.524 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -82.29 -56.87 3.65 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.05 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.467 HG23 ' HA ' ' A' ' 44' ' ' GLN . 21.5 m -71.55 -43.79 71.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.254 0.55 . . . . 0.0 111.301 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.536 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.61 -55.03 35.09 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.716 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.512 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 19.5 m-30 -62.71 -22.52 66.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 120.722 0.296 . . . . 0.0 110.443 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -64.48 -52.01 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.166 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -79.82 -34.59 39.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.05 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.499 ' HG2' ' CZ3' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -80.27 -26.5 38.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.132 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.484 ' N ' ' O ' ' A' ' 49' ' ' PHE . 8.6 ttm180 -133.24 35.39 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.718 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 4.3 ttm . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.744 179.586 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.648 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.648 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.5 Cg_endo -50.52 -24.32 12.27 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.821 1.681 . . . . 0.0 110.876 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 15' ' ' PHE . 28.3 mt-30 -48.46 -25.71 1.79 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.87 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.63 -55.27 5.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 0.0 109.935 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -81.93 -37.11 27.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.861 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -64.83 -55.08 21.75 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.506 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.506 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -55.31 -51.88 65.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.014 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.485 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.8 tp -66.05 -33.56 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.632 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.7 mm-40 -51.29 -64.47 0.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -61.34 -36.4 80.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.481 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.477 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 93.4 t -58.52 -66.85 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.417 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 65.6 t80 -59.51 -18.24 38.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.818 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.632 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -75.39 -39.8 58.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.982 0.42 . . . . 0.0 110.618 179.796 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.0 mtp180 -59.52 -40.0 85.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.706 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.5 ptmt -168.89 -144.75 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.427 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.518 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.5 mm-40 -144.58 -50.25 0.27 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 111.38 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.8 t -85.83 74.39 10.2 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.485 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 2.9 mt -72.75 129.4 38.11 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.48 -179.65 4.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.753 0.311 . . . . 0.0 110.655 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.0 m -52.21 -26.94 12.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.19 0.519 . . . . 0.0 110.262 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.44 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.14 -50.23 12.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.61 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' A' ' 34' ' ' VAL . 1.6 mt-10 -70.67 -39.37 73.6 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.815 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 3.3 pttp -59.0 -34.88 72.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.224 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -90.31 -37.85 13.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.578 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.44 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 5.0 mm-40 -73.13 -35.62 66.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.621 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.507 ' N ' ' O ' ' A' ' 30' ' ' GLU . 94.3 t -79.63 -38.5 19.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.163 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.612 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -63.32 -33.42 75.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.336 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -88.22 -19.95 26.17 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.404 ' CG ' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -101.91 -28.84 12.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.62 -179.111 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 71.4 m -95.9 -29.36 14.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.154 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.94 26.88 2.89 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.344 -0.932 . . . . 0.0 113.579 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.612 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -113.1 -161.91 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.053 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.445 ' CG2' ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -149.99 151.25 31.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.495 0.188 . . . . 0.0 110.704 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.445 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 4.7 Cg_endo -47.12 -27.42 6.31 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.83 2.354 . . . . 0.0 112.195 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 10.5 tp -84.81 -28.74 25.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.525 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 48' ' ' TRP . 38.8 mm-40 -81.74 -58.1 3.15 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.84 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.552 HG12 ' HB3' ' A' ' 35' ' ' ALA . 20.2 m -36.2 -33.16 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.581 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.502 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -83.31 -55.85 4.09 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.831 179.662 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' A' ' 44' ' ' GLN . 28.7 m -70.8 -44.03 76.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.344 0.593 . . . . 0.0 111.368 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.502 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -62.15 -53.24 58.2 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.124 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.506 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 19.8 m-30 -65.48 -27.41 68.48 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.699 0.285 . . . . 0.0 110.601 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.502 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -54.59 -55.17 16.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.804 0.335 . . . . 0.0 110.763 -179.775 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -79.53 -29.97 41.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.716 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.414 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 23.5 mmtt -90.24 10.53 24.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.15 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.48 ' N ' ' O ' ' A' ' 49' ' ' PHE . 12.1 ttp180 -170.38 32.27 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.491 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-O 120.97 0.414 . . . . 0.0 110.76 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.4 Cg_endo -50.87 -24.42 13.58 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.846 1.697 . . . . 0.0 110.965 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.5 ' O ' ' N ' ' A' ' 15' ' ' PHE . 1.1 mt-30 -49.95 -23.47 2.01 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.031 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.19 -55.8 7.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.143 0.497 . . . . 0.0 109.948 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -81.26 -35.31 31.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.635 178.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.5 -55.29 18.7 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.168 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.524 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -53.08 -50.84 63.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.841 179.526 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.478 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.2 tp -69.14 -32.24 71.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.651 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -51.47 -56.98 10.33 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.117 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -69.38 -34.31 74.35 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.717 179.417 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.484 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 90.7 t -58.54 -67.03 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.843 0.354 . . . . 0.0 110.046 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.404 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 23.8 t80 -59.1 -16.91 21.86 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.951 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.651 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.91 -40.5 47.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.028 0.442 . . . . 0.0 111.046 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.8 -38.82 79.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.035 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.476 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -166.27 -139.58 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.467 179.649 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.476 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 16.0 mm-40 -148.27 -46.88 0.16 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.917 0.389 . . . . 0.0 111.362 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.415 ' HA ' ' CZ ' ' A' ' 53' ' ' ARG . 20.8 t -93.61 78.27 4.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.328 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.51 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 4.5 mt -74.13 121.36 21.04 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -90.36 177.02 6.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.745 0.307 . . . . 0.0 110.879 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.25 -28.19 2.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.952 0.406 . . . . 0.0 111.071 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 5.6 mmpt? -78.36 -48.4 15.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.635 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.524 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 5.2 mt-10 -70.96 -37.78 72.81 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.884 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.535 ' O ' ' HB1' ' A' ' 35' ' ' ALA . 35.2 pttt -60.3 -34.82 74.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.038 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -90.06 -37.45 14.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.549 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 9.6 mm-40 -73.47 -35.41 65.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.642 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.524 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 86.3 t -80.09 -37.76 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.295 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.608 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -64.5 -32.02 73.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.477 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.6 ptmt -87.7 -19.34 27.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.328 -0.396 . . . . 0.0 112.032 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.59 -27.37 12.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.624 0.249 . . . . 0.0 111.492 -179.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 77.8 m -96.64 -29.0 14.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.24 24.88 4.0 Favored Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.306 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.608 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -110.4 -165.43 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.06 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.439 ' CG2' ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -146.27 151.77 44.98 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 120.573 0.225 . . . . 0.0 110.624 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.439 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 4.8 Cg_endo -46.9 -29.1 7.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.745 2.296 . . . . 0.0 112.148 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 31.7 tp -82.42 -29.31 30.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.589 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.517 ' O ' ' N ' ' A' ' 48' ' ' TRP . 36.4 mm-40 -81.44 -58.91 2.82 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.897 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.554 HG13 ' HB2' ' A' ' 35' ' ' ALA . 21.2 m -35.89 -33.39 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.483 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.529 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -82.56 -56.38 3.9 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.793 179.609 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.482 HG23 ' HA ' ' A' ' 44' ' ' GLN . 27.5 m -69.84 -43.3 79.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.402 0.62 . . . . 0.0 111.117 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.517 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -62.32 -53.78 50.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.982 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.575 ' O ' ' HB3' ' A' ' 53' ' ' ARG . 20.6 m-30 -66.55 -20.49 66.03 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.657 0.265 . . . . 0.0 110.741 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -59.85 -59.99 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.181 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -72.94 -43.1 62.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.406 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.438 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 43.5 mmtt -71.18 -33.64 70.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.595 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 2.3 tmt_? -123.13 34.59 5.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.471 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 4.9 ttp . . . . . 0 C--N 1.332 -0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.916 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.681 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.7 Cg_endo -50.39 -25.02 13.04 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 121.78 1.654 . . . . 0.0 111.082 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.441 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -50.79 -23.67 2.91 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.79 179.115 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.89 -54.51 12.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.157 0.503 . . . . 0.0 109.814 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -36.52 27.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.723 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -65.22 -54.06 35.11 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.574 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.505 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -58.03 -52.5 65.26 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.486 ' N ' ' CG ' ' A' ' 15' ' ' PHE . 2.5 tp -63.25 -32.58 74.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.81 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.494 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -53.66 -66.59 0.37 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.097 179.332 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -27.42 66.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.476 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 98.0 t -70.69 -63.28 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.06 0.457 . . . . 0.0 110.731 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.406 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 61.0 t80 -68.42 -11.51 59.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.544 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.494 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -85.73 -36.62 20.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.57 -179.688 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.229 0.538 . . . . 0.0 110.218 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.464 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -162.37 -143.1 0.08 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.951 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.406 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 20.1 mm-40 -147.07 -44.82 0.18 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.543 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -101.54 90.39 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.495 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 6.7 mt -86.0 130.54 34.51 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.413 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 3.2 p30 -95.48 -176.65 3.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 11.3 t -52.13 -29.26 21.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.31 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.02 -47.74 17.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.6 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.507 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 23.9 mt-10 -72.05 -36.99 69.76 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.818 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.516 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 4.3 pttp -60.89 -34.24 74.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.02 0.438 . . . . 0.0 109.947 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -90.02 -36.39 14.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.534 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -74.94 -35.11 62.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.59 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 93.3 t -80.12 -36.78 16.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.589 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -65.84 -29.64 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.503 . . . . 0.0 112.078 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -87.23 -19.92 27.66 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 5.3 ptmm? -103.93 -26.85 12.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.686 0.279 . . . . 0.0 111.513 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 61.2 m -95.21 -27.72 15.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 113.24 24.72 4.68 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.321 -0.943 . . . . 0.0 113.404 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.589 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.55 -165.36 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.163 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.52 158.02 47.43 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 120.769 0.318 . . . . 0.0 111.203 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.413 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 56.6 Cg_exo -51.61 -23.76 15.79 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.647 2.231 . . . . 0.0 112.374 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.2 tp -91.6 -25.51 19.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.745 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.537 ' O ' ' N ' ' A' ' 48' ' ' TRP . 36.4 mm-40 -82.99 -58.54 2.82 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 109.882 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.57 HG12 ' HB1' ' A' ' 35' ' ' ALA . 20.7 m -36.53 -33.23 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.218 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.497 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.75 -59.74 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.767 179.563 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.456 HG21 ' HA ' ' A' ' 44' ' ' GLN . 20.6 m -68.53 -44.06 83.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.224 0.535 . . . . 0.0 111.38 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.537 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.41 -54.05 48.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.962 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.514 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 20.8 m-30 -64.23 -29.61 70.71 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.458 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.497 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -52.84 -51.68 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.908 0.385 . . . . 0.0 110.573 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -79.63 -29.52 41.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.548 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.464 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 52.6 mmtt -94.84 18.36 11.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.9 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' PHE . 12.6 ttp180 -176.27 30.63 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.207 0 CA-C-O 120.866 0.365 . . . . 0.0 110.99 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.665 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.665 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.1 Cg_endo -52.92 -22.81 19.28 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 121.589 1.526 . . . . 0.0 111.028 179.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.529 ' O ' ' N ' ' A' ' 15' ' ' PHE . 28.0 mt-30 -49.76 -26.95 4.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.547 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.46 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -41.66 -59.68 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.249 0.547 . . . . 0.0 110.121 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -81.51 -35.21 30.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.701 178.842 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.2 -57.73 8.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.234 -179.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.61 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -55.35 -45.06 76.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.504 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.562 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -69.9 -31.69 69.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.911 179.123 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.6 OUTLIER -54.36 -64.61 0.78 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.581 179.049 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -32.33 69.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.304 178.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.455 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 25.0 t -59.02 -57.24 12.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.991 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.411 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 9.0 t80 -73.41 -11.8 60.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.739 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.13 -37.4 28.91 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.504 179.665 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -60.24 -42.1 94.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.335 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.443 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -160.64 -155.3 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.473 179.746 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.409 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 29.2 mm-40 -139.72 -47.99 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 111.551 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 t -77.9 73.77 4.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.455 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.443 ' CD2' ' HG3' ' A' ' 23' ' ' LYS . 0.7 OUTLIER -80.32 115.72 20.01 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.502 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.59 -177.26 3.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.732 0.301 . . . . 0.0 110.626 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.401 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 0.9 OUTLIER -52.1 -26.48 11.26 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.147 0.499 . . . . 0.0 110.604 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.418 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.54 -49.39 13.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.827 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.517 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.0 mm-40 -72.29 -36.45 68.97 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.798 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.534 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 31.7 pttt -60.67 -34.99 75.13 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.077 0.465 . . . . 0.0 109.882 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -90.1 -35.61 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.69 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -75.54 -35.46 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.741 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.517 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 83.4 t -79.46 -39.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.311 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.707 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -60.81 -34.33 74.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.753 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -87.95 -19.11 27.7 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -19.8 13.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 76.9 m -106.34 -27.15 11.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.32 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.3 21.87 4.3 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 120.124 -1.036 . . . . 0.0 114.037 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.707 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -110.27 -164.77 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.05 0.425 . . . . 0.0 110.166 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.408 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -148.8 156.98 41.24 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.676 0.275 . . . . 0.0 110.931 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -49.67 -26.87 13.79 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.62 2.213 . . . . 0.0 112.496 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.488 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.4 tp -88.91 -29.01 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 0.0 110.562 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.497 ' HA ' HG23 ' A' ' 47' ' ' VAL . 35.8 mm-40 -80.57 -58.23 3.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.77 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.513 ' O ' ' HB2' ' A' ' 49' ' ' PHE . 22.7 m -35.73 -35.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.508 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.509 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -79.7 -55.39 5.04 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.667 179.526 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.497 HG23 ' HA ' ' A' ' 44' ' ' GLN . 29.7 m -69.84 -44.27 79.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.457 0.646 . . . . 0.0 111.202 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.472 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -62.43 -51.49 67.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.211 -179.459 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.513 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 22.5 m-30 -67.57 -25.73 65.94 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.525 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -56.96 -50.58 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.953 0.406 . . . . 0.0 110.375 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -80.42 -32.23 37.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.523 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -92.95 16.1 13.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.027 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -178.15 35.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.11 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.407 . . . . 0.0 110.654 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.667 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.329 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.667 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -52.09 -23.69 17.93 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.81 1.674 . . . . 0.0 110.952 179.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -52.12 -24.94 7.73 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.661 179.012 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.99 -59.22 2.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.265 0.555 . . . . 0.0 110.081 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -82.07 -34.97 29.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.668 178.858 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.71 -53.91 43.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.011 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.561 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -57.0 -46.97 81.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.34 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.53 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -69.86 -30.03 67.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.264 179.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.511 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.9 mt-10 -54.88 -62.8 1.42 Allowed 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.533 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -60.76 -30.97 70.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.986 178.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.501 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 54.4 t -61.76 -61.88 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.423 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 34.4 t80 -65.6 -14.86 62.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.638 178.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.27 -40.13 52.53 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.97 0.414 . . . . 0.0 110.493 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -59.12 -42.96 91.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.719 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -161.48 -145.61 0.11 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.55 179.372 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.48 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.12 -50.54 0.43 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.026 0.441 . . . . 0.0 111.589 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -95.29 81.27 3.6 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.48 ' CD2' ' CG ' ' A' ' 23' ' ' LYS . 4.4 mt -74.5 135.61 42.21 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.9 -178.64 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.407 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 1.3 m -51.13 -27.4 8.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.194 0.521 . . . . 0.0 110.439 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.79 -50.36 11.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.871 179.852 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' A' ' 34' ' ' VAL . 5.3 mt-10 -71.02 -37.99 72.6 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.046 0.45 . . . . 0.0 109.795 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 3.7 pttp -60.5 -34.84 74.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.954 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.53 -35.95 15.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.625 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -75.28 -35.74 61.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.575 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 30' ' ' GLU . 85.6 t -78.67 -37.47 20.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.102 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.681 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -65.47 -30.83 71.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.037 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -87.48 -19.89 27.33 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.404 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.1 OUTLIER -105.37 -23.31 12.87 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.499 -179.398 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 64.3 m -98.68 -28.27 13.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.37 21.76 5.06 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.363 -0.922 . . . . 0.0 113.454 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.681 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.14 -163.37 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.92 157.66 35.41 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.693 0.282 . . . . 0.0 111.104 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.404 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 77.1 Cg_exo -50.27 -25.01 12.63 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.498 2.132 . . . . 0.0 112.249 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.504 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -89.33 -30.28 18.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.588 179.607 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.537 ' HA ' HG23 ' A' ' 47' ' ' VAL . 32.8 mm-40 -80.47 -58.27 3.2 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.856 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.54 ' O ' ' CD2' ' A' ' 49' ' ' PHE . 21.0 m -34.69 -41.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.841 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -71.56 -60.48 2.21 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.719 179.063 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.537 HG23 ' HA ' ' A' ' 44' ' ' GLN . 15.3 m -63.38 -44.13 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 121.264 0.554 . . . . 0.0 111.259 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.472 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -61.99 -53.64 52.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.957 -179.38 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.54 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 22.7 m-85 -68.59 -18.72 64.38 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 120.667 0.27 . . . . 0.0 110.858 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -62.39 -55.75 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.846 0.355 . . . . 0.0 110.379 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -78.14 -34.07 50.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.217 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.414 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 49.1 mmtt -77.84 -31.88 51.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.133 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 49' ' ' PHE . 8.1 ttp180 -125.36 31.89 5.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.424 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.664 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.292 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.664 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -53.46 -22.3 20.98 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 121.62 1.547 . . . . 0.0 110.961 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.516 ' O ' ' N ' ' A' ' 15' ' ' PHE . 27.3 mt-30 -50.09 -26.32 4.34 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.807 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -41.94 -58.38 2.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.286 0.565 . . . . 0.0 110.125 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.416 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -81.81 -37.67 26.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.779 178.79 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.32 -56.08 24.5 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.831 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.598 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -53.1 -48.86 67.47 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.675 179.143 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.542 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -67.22 -30.06 69.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.201 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -55.78 -65.37 0.61 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.57 179.064 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -59.35 -28.86 67.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.371 178.909 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.51 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 42.0 t -62.38 -60.26 3.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.342 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.415 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 26.9 t80 -68.94 -13.02 62.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -83.69 -35.01 24.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.903 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 46.2 mtp85 -59.46 -39.52 83.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.176 0.512 . . . . 0.0 110.313 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.495 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -158.62 -145.5 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.394 179.177 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.465 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.72 -50.6 0.41 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.078 0.466 . . . . 0.0 111.59 -179.032 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.2 t -95.63 81.25 3.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.724 -178.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.495 ' CD2' ' CG ' ' A' ' 23' ' ' LYS . 3.7 mt -73.42 117.13 14.8 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -93.45 175.69 6.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.647 0.261 . . . . 0.0 110.871 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.5 m -44.66 -29.85 0.82 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.997 0.427 . . . . 0.0 111.131 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.7 mmpt? -78.01 -48.6 15.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.763 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.512 ' O ' ' N ' ' A' ' 34' ' ' VAL . 3.3 mt-10 -71.14 -37.96 72.26 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.979 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.563 ' O ' ' HB1' ' A' ' 35' ' ' ALA . 13.3 pttt -60.74 -34.14 73.98 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.65 -36.58 15.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.406 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.8 mm-40 -74.5 -35.82 63.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.487 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.512 ' N ' ' O ' ' A' ' 30' ' ' GLU . 75.3 t -78.33 -37.82 22.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.017 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.68 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -65.15 -31.16 72.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.059 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ptmt -87.47 -19.76 27.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.434 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.45 -23.55 12.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.585 0.231 . . . . 0.0 111.571 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 61.0 m -99.78 -25.56 14.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.482 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.23 26.9 4.13 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.304 -0.95 . . . . 0.0 113.582 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.68 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -115.48 -164.22 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.067 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.403 ' CG2' ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.38 159.15 35.39 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.31 . . . . 0.0 111.135 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.403 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 65.9 Cg_exo -51.27 -24.45 15.56 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.527 2.151 . . . . 0.0 112.304 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -89.73 -31.28 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.181 179.666 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 48' ' ' TRP . 26.8 mm-40 -79.63 -58.15 3.33 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.802 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.55 ' O ' ' CD2' ' A' ' 49' ' ' PHE . 23.9 m -35.14 -43.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.019 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -70.29 -59.61 2.77 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.922 179.362 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.486 HG22 ' HA ' ' A' ' 44' ' ' GLN . 19.0 m -65.21 -45.22 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 121.235 0.54 . . . . 0.0 111.522 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.502 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -60.87 -52.74 63.76 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.001 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.55 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 22.4 m-85 -67.85 -25.39 65.52 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.628 0.252 . . . . 0.0 110.805 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -56.46 -53.92 34.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -79.84 -29.2 40.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.685 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.447 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 15.0 mmtt -93.0 12.64 23.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.173 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 11.6 ttp180 -174.35 34.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ttm . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 110.912 -179.881 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.669 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.669 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.2 Cg_endo -50.57 -22.47 9.26 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.553 1.502 . . . . 0.0 111.076 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' PHE . 29.0 mt-30 -47.79 -25.62 1.33 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.948 179.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.41 -55.87 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 109.987 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.11 -35.73 31.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.974 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 17' ' ' GLU . . . -66.46 -54.46 23.84 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.248 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.526 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -53.32 -49.25 67.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.977 179.532 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.504 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -71.15 -33.88 70.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.914 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.677 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.3 mm-40 -49.72 -54.82 16.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.172 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -70.21 -33.86 72.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.402 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.466 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 97.9 t -59.63 -65.42 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -60.75 -18.68 56.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.775 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.677 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.5 OUTLIER -72.61 -41.8 65.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.43 . . . . 0.0 110.358 179.654 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -61.26 -41.33 96.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.506 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.487 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -169.07 -156.78 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.24 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -134.56 -51.01 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.99 0.424 . . . . 0.0 111.607 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.6 t -84.12 78.54 9.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.52 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.487 ' CD2' ' HG3' ' A' ' 23' ' ' LYS . 1.8 mt -76.04 134.25 40.14 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.415 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -98.27 178.78 4.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.673 0.273 . . . . 0.0 110.416 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.4 m -51.23 -27.11 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.215 0.531 . . . . 0.0 110.405 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.11 -51.27 10.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.839 179.87 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.506 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.3 mt-10 -70.53 -39.1 74.24 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.834 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.561 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 9.5 pttt -59.19 -35.24 73.23 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.72 -37.97 14.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.494 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 11.0 mm-40 -72.9 -35.09 67.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.764 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 85.0 t -79.81 -39.11 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.317 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.671 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -63.96 -29.85 70.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.125 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -87.31 -21.91 25.45 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.435 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 9.8 ptmt -102.72 -30.45 10.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.73 0.3 . . . . 0.0 111.396 -179.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 75.7 m -90.42 -29.9 17.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.047 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.33 21.5 5.16 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.355 -0.926 . . . . 0.0 113.408 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.671 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -106.5 -161.96 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.43 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -152.31 155.35 33.03 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 111.119 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.407 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 71.0 Cg_exo -48.86 -25.91 9.14 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.572 2.181 . . . . 0.0 112.306 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 4.9 tp -87.86 -28.97 21.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.593 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.53 ' O ' ' N ' ' A' ' 48' ' ' TRP . 35.8 mm-40 -82.44 -58.53 2.89 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.984 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.515 HG11 ' HB3' ' A' ' 35' ' ' ALA . 24.6 m -35.9 -34.09 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.202 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.517 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.2 -58.8 2.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.078 179.482 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.475 HG22 ' HA ' ' A' ' 44' ' ' GLN . 20.0 m -70.11 -44.57 78.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.276 0.56 . . . . 0.0 111.448 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.53 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -60.33 -55.68 30.7 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.655 -179.595 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.51 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 19.8 m-30 -61.44 -26.9 68.18 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.488 178.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.517 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.9 mm -59.62 -51.83 68.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.329 . . . . 0.0 110.485 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -80.59 -39.39 27.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.215 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.492 ' HG2' ' CZ3' ' A' ' 48' ' ' TRP . 0.7 OUTLIER -75.2 -21.94 58.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.225 -179.785 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 7.2 ttm180 -134.96 30.21 3.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.564 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.415 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.8 ttp . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 120.88 0.371 . . . . 0.0 111.033 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.66 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.177 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.66 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.3 Cg_endo -51.06 -23.97 13.47 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 121.638 1.558 . . . . 0.0 110.895 179.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.559 ' O ' ' N ' ' A' ' 15' ' ' PHE . 29.5 mt-30 -47.96 -27.27 2.11 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.858 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.415 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -42.92 -57.8 2.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.23 0.538 . . . . 0.0 110.04 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.446 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.86 -34.15 30.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.768 178.886 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.41 -57.5 7.27 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.559 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -53.13 -47.99 68.26 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.168 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.513 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -67.61 -39.46 84.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.812 178.675 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.637 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.7 mm-40 -45.88 -61.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.338 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -64.61 -34.22 77.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.386 179.169 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.517 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 54.9 t -57.77 -65.9 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.108 0.48 . . . . 0.0 109.896 178.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.444 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 41.3 t80 -62.26 -15.0 44.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.711 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.637 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -81.07 -36.92 29.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.921 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.48 -37.24 77.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.074 0.464 . . . . 0.0 110.501 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.506 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -167.8 -143.95 0.05 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.494 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.506 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 29.3 mm-40 -145.82 -48.75 0.22 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.007 0.432 . . . . 0.0 111.59 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 t -83.24 71.08 10.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.342 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.479 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 2.7 mt -74.1 110.65 8.56 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.04 179.8 5.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.189 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.9 m -44.92 -30.61 1.04 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.737 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.1 mmpt? -78.25 -48.86 14.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.932 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.512 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.6 mt-10 -71.4 -37.92 71.48 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.816 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.539 ' HB2' ' CG2' ' A' ' 45' ' ' VAL . 32.3 pttt -59.66 -34.97 73.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.049 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -90.18 -37.21 14.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.574 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.1 mm-40 -73.57 -35.3 65.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.639 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.512 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 75.8 t -79.01 -40.71 22.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.36 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.65 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -61.05 -31.25 70.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.006 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -87.63 -19.45 27.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -105.5 -23.42 12.81 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.543 -179.403 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 60.8 m -99.42 -28.39 13.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.274 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.55 20.39 5.45 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.709 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.65 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -106.61 -167.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 178.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.409 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -144.19 155.53 58.15 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.293 . . . . 0.0 111.119 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.403 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 75.6 Cg_exo -49.41 -25.92 11.1 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.702 2.268 . . . . 0.0 112.524 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.495 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -89.01 -27.1 21.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.08 0.467 . . . . 0.0 110.784 179.78 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.539 ' O ' ' N ' ' A' ' 48' ' ' TRP . 38.6 mm-40 -81.89 -58.96 2.75 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.817 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.545 HG12 ' HB2' ' A' ' 35' ' ' ALA . 25.6 m -36.7 -34.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.186 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.701 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -78.71 -62.75 1.59 Allowed 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.031 179.577 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.455 ' CG2' ' N ' ' A' ' 48' ' ' TRP . 11.1 m -70.27 -46.9 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 111.67 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.539 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -56.57 -48.41 77.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.612 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.536 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 15.9 m-30 -65.62 -31.86 73.13 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.905 179.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.701 HG12 ' O ' ' A' ' 46' ' ' ARG . 2.7 mm -49.75 -52.34 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.97 0.414 . . . . 0.0 110.566 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.37 -33.67 48.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.145 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.45 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 22.9 mmtt -95.54 22.87 6.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.168 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 49' ' ' PHE . 5.3 ttp180 -178.9 29.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.315 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.332 -0.17 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.658 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.248 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.658 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 12.4 Cg_endo -54.52 -20.85 22.16 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 121.658 1.572 . . . . 0.0 110.945 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.545 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -53.18 -23.22 7.87 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.891 179.253 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.417 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -46.06 -58.28 3.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.274 0.559 . . . . 0.0 110.114 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.78 -35.65 32.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.702 179.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.51 -51.12 62.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.405 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.589 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -56.5 -48.06 77.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.372 179.936 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.579 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -75.39 -27.34 59.05 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.177 179.344 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.1 mt-10 -54.25 -59.46 4.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -62.65 -32.16 73.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.989 178.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.443 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 55.8 t -60.27 -59.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.411 179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.428 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 18.5 t80 -68.52 -14.01 62.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.901 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.64 -36.17 26.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.857 0.36 . . . . 0.0 110.558 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -60.84 -37.92 83.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.57 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.491 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 1.1 ptmm? -164.44 -147.91 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.372 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.491 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 27.6 mm-40 -146.34 -48.53 0.2 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.903 0.382 . . . . 0.0 111.675 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.3 t -83.18 73.64 10.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.448 ' CD2' ' CG ' ' A' ' 23' ' ' LYS . 1.0 OUTLIER -74.65 117.0 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -94.99 177.09 6.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.875 0.369 . . . . 0.0 110.934 -179.641 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.4 m -47.93 -29.14 3.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.161 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 3.4 mmpt? -78.23 -48.55 15.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.793 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.523 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.2 mt-10 -71.75 -36.83 70.55 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.946 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.543 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 16.1 pttt -61.54 -34.55 75.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.001 0.429 . . . . 0.0 110.057 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -89.83 -36.44 15.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.505 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 7.3 mm-40 -74.72 -35.53 62.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.683 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 79.6 t -79.16 -38.92 20.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.245 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.683 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -63.1 -31.68 72.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.95 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -87.71 -20.21 26.55 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.462 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 1.4 pttp -105.35 -24.19 12.71 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.529 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 77.0 m -98.15 -27.77 14.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.228 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.77 23.85 4.19 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.16 -1.019 . . . . 0.0 113.702 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.683 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -112.01 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.953 0.376 . . . . 0.0 110.117 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.67 157.11 44.8 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.775 0.321 . . . . 0.0 111.003 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -51.19 -23.99 14.2 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.58 2.187 . . . . 0.0 112.3 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.506 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -91.38 -28.3 17.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.1 0.476 . . . . 0.0 110.757 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.531 ' O ' ' N ' ' A' ' 48' ' ' TRP . 28.5 mm-40 -80.97 -57.0 3.73 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.56 ' O ' ' CD2' ' A' ' 49' ' ' PHE . 18.6 m -36.23 -36.4 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.117 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -78.14 -57.57 3.72 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.834 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.492 HG23 ' HA ' ' A' ' 44' ' ' GLN . 21.0 m -68.27 -44.87 83.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.214 0.531 . . . . 0.0 111.451 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.531 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.05 -53.2 60.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.958 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.56 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 23.0 m-30 -66.46 -28.9 68.95 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.672 0.272 . . . . 0.0 110.521 179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -54.93 -52.74 40.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.861 0.362 . . . . 0.0 110.562 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -78.01 -29.07 49.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.159 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.461 ' HG3' ' CE3' ' A' ' 48' ' ' TRP . 35.5 mmtt -94.87 19.0 10.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.791 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 49' ' ' PHE . 11.1 ttp-105 -178.34 33.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.061 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 ttm . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.01 0.433 . . . . 0.0 110.72 -179.915 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.685 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.685 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.3 Cg_endo -50.85 -23.93 12.61 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.904 1.736 . . . . 0.0 110.949 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.437 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.8 OUTLIER -50.34 -22.77 1.96 Allowed 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.083 179.047 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -48.12 -56.88 6.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.298 0.571 . . . . 0.0 109.747 178.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.425 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -81.22 -34.41 32.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.712 179.039 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.421 ' HA ' ' HB2' ' A' ' 17' ' ' GLU . . . -66.54 -48.41 69.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.411 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -58.81 -45.1 90.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.889 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.549 HD21 ' HG3' ' A' ' 52' ' ' LYS . 24.1 tp -76.13 -30.78 58.33 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.926 178.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.547 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 2.5 mt-10 -52.23 -43.45 64.31 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.83 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -81.77 -28.21 33.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.584 179.242 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.438 HG12 ' CZ ' ' A' ' 49' ' ' PHE . 86.6 t -67.2 -64.02 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.876 0.37 . . . . 0.0 110.388 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.447 ' CE2' ' HG3' ' A' ' 53' ' ' ARG . 11.0 t80 -60.4 -26.47 66.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.772 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.547 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -77.43 -42.63 35.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.498 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.6 mtp85 -59.74 -40.13 87.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.499 . . . . 0.0 110.194 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.456 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.22 -160.35 0.54 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.519 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 41.0 mm-40 -141.99 -46.63 0.35 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.207 0.527 . . . . 0.0 111.526 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.9 t -74.99 71.38 2.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.158 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.468 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -76.78 109.51 10.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.958 178.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 -179.15 4.65 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.6 t -50.74 -28.43 9.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.187 0.517 . . . . 0.0 110.347 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.445 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.01 -50.91 11.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.958 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.505 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.0 mm-40 -70.89 -38.41 73.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.032 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.561 ' HB2' ' CG2' ' A' ' 45' ' ' VAL . 6.4 pttp -60.23 -34.68 74.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.025 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.81 -37.19 13.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.584 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.5 mm-40 -73.8 -37.34 64.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.872 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.505 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 93.3 t -78.18 -40.0 25.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.299 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.622 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -60.95 -31.74 71.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.443 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -88.06 -19.9 26.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.34 -25.73 13.19 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.646 -179.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.9 m -98.27 -28.71 13.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.139 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.73 20.69 4.89 Favored Glycine 0 C--N 1.33 0.21 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.504 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.622 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.1 OUTLIER -105.77 -163.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.413 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -148.49 157.2 42.01 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.692 0.282 . . . . 0.0 111.074 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.423 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 63.2 Cg_exo -51.52 -23.8 15.43 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.599 2.199 . . . . 0.0 112.281 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -90.7 -27.23 19.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.056 0.455 . . . . 0.0 110.694 179.693 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 48' ' ' TRP . 35.7 mm-40 -81.5 -59.5 2.6 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.829 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.581 HG12 ' HB3' ' A' ' 35' ' ' ALA . 20.5 m -35.82 -32.96 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.445 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.488 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.77 -59.94 2.42 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.6 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.448 HG22 ' HA ' ' A' ' 44' ' ' GLN . 19.9 m -67.95 -43.86 85.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.359 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.499 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -62.0 -54.08 46.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.042 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.507 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 21.6 m-30 -65.88 -24.61 66.89 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.704 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -55.49 -58.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.677 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -79.17 -32.4 44.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.051 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.549 ' HG3' HD21 ' A' ' 16' ' ' LEU . 13.6 mmtt -85.15 1.02 49.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.539 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -164.93 37.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.971 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.3 ttp . . . . . 0 C--N 1.328 -0.326 0 CA-C-O 120.976 0.417 . . . . 0.0 110.822 179.939 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.652 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.283 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.652 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.55 -24.25 12.24 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.607 1.538 . . . . 0.0 111.087 179.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.559 ' O ' ' N ' ' A' ' 15' ' ' PHE . 28.8 mt-30 -48.83 -26.85 2.63 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.579 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.95 -55.05 5.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.219 0.533 . . . . 0.0 110.025 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -81.54 -36.34 29.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.678 178.956 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.51 -57.44 7.31 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.515 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.559 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -53.73 -49.09 68.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.93 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.447 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 2.2 tp -68.91 -34.15 74.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.098 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.664 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -49.97 -59.53 3.79 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.159 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.31 -37.1 84.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.758 179.476 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.476 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 93.0 t -56.12 -68.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.831 0.348 . . . . 0.0 110.085 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -16.29 15.92 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.989 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.664 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -80.0 -37.96 33.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.745 0.307 . . . . 0.0 111.223 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 -59.06 -37.33 76.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.468 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.2 ptmt -167.15 -145.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.537 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.445 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -140.68 -50.25 0.45 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.928 0.395 . . . . 0.0 111.716 -179.131 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.6 78.57 4.31 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.494 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 5.1 mt -72.3 124.71 25.65 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.01 176.89 5.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.756 0.312 . . . . 0.0 111.145 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.412 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 12.0 t -44.69 -31.17 1.09 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.8 mmpt? -78.66 -47.22 17.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.914 0.388 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.2 mt-10 -70.69 -38.34 73.68 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.81 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.559 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 7.1 pttt -59.95 -34.98 73.99 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -89.72 -37.38 14.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.545 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -73.05 -35.73 66.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.555 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.516 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 80.1 t -79.48 -38.16 19.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.252 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.614 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -64.6 -31.87 73.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.441 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -87.82 -19.6 27.24 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -26.2 13.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.661 0.267 . . . . 0.0 111.566 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 86.2 m -97.6 -28.44 13.94 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.299 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.42 23.33 4.48 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.35 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.614 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.8 -163.89 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.086 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.436 ' CG2' ' HD2' ' A' ' 42' ' ' PRO . 0.0 OUTLIER -149.18 153.02 37.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.591 0.234 . . . . 0.0 110.809 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.436 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 5.0 Cg_endo -47.38 -26.97 6.47 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.827 2.351 . . . . 0.0 112.239 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.462 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.6 OUTLIER -84.1 -30.33 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.588 179.641 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.509 ' O ' ' N ' ' A' ' 48' ' ' TRP . 25.9 mm-40 -81.77 -57.55 3.39 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.779 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.527 HG13 ' HB1' ' A' ' 35' ' ' ALA . 22.8 m -36.69 -32.75 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.422 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.509 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -83.32 -56.5 3.73 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.886 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.501 HG23 ' HA ' ' A' ' 44' ' ' GLN . 28.2 m -69.8 -42.82 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.376 0.608 . . . . 0.0 111.178 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.509 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -63.33 -55.86 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.829 -179.53 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.527 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 20.1 m-30 -64.15 -18.87 64.87 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-O 120.682 0.277 . . . . 0.0 110.588 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -64.45 -55.36 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.893 0.377 . . . . 0.0 110.388 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 -77.72 -34.9 52.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.916 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.442 ' HG3' HD13 ' A' ' 16' ' ' LEU . 15.2 mmtt -81.47 -19.56 42.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.132 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.476 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 8.9 ttm180 -145.04 44.03 1.33 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.741 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.996 0.427 . . . . 0.0 110.48 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.666 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.293 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.666 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.7 Cg_endo -50.75 -24.38 13.13 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.936 1.757 . . . . 0.0 111.02 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.52 ' O ' ' N ' ' A' ' 15' ' ' PHE . 1.3 mt-30 -49.98 -26.33 4.15 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.837 179.091 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.442 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -41.7 -59.76 1.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.303 0.573 . . . . 0.0 110.058 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.438 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.32 -33.93 28.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.517 178.674 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.69 -58.19 6.96 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.344 -179.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.563 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -57.73 -45.15 86.19 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.563 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -67.59 -36.17 80.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.022 0.439 . . . . 0.0 109.963 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.8 mt-10 -50.03 -66.4 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.701 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -58.69 -34.78 71.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.485 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 34.4 t -58.31 -59.08 4.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.0 0.428 . . . . 0.0 110.243 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.431 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 5.1 t80 -69.75 -12.92 62.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.144 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -84.82 -37.39 20.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.858 0.361 . . . . 0.0 110.955 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.42 -37.11 84.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.652 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.591 ' HD2' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -160.01 -164.76 1.35 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.546 179.851 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 20' ' ' PHE . 40.8 mm-40 -137.78 -20.88 1.13 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.227 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.8 t -102.89 74.33 1.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.583 HD23 ' HD3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -71.5 97.57 1.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.324 178.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.431 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -88.46 172.17 9.56 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.257 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.9 t -44.53 -31.21 1.04 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.1 mmpt? -78.18 -49.75 13.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.833 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.53 ' O ' ' N ' ' A' ' 34' ' ' VAL . 1.9 mm-40 -68.94 -41.82 77.57 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.913 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 6.9 pttp -57.52 -35.48 70.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.29 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -89.04 -37.57 15.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.58 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.432 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.2 mm-40 -73.48 -35.52 65.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.602 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.53 ' N ' ' O ' ' A' ' 30' ' ' GLU . 81.2 t -79.42 -38.41 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.298 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.663 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -62.45 -35.09 78.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.456 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.12 -19.69 26.66 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.094 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.58 -25.47 13.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 76.5 m -101.64 -28.3 12.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.305 -179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.08 23.85 3.45 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.251 -0.976 . . . . 0.0 114.096 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.663 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -110.8 -163.13 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 178.924 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.427 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -150.92 154.13 34.06 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 0.0 110.945 180.0 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -47.42 -27.12 6.79 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.707 2.271 . . . . 0.0 112.382 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -88.47 -29.96 19.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.501 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 48' ' ' TRP . 33.7 mm-40 -80.38 -58.75 2.98 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.775 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.538 ' O ' ' CD2' ' A' ' 49' ' ' PHE . 26.9 m -34.79 -40.36 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.817 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.544 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -71.54 -61.58 1.72 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.783 179.264 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.457 HG21 ' HA ' ' A' ' 44' ' ' GLN . 16.8 m -64.6 -43.59 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 121.427 0.632 . . . . 0.0 111.386 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.474 ' HB2' ' O ' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -62.88 -51.45 66.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.249 -178.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.538 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 22.1 m-85 -70.2 -19.64 63.16 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.895 179.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.3 mm -59.63 -66.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.28 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -66.58 -39.77 88.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.244 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.435 ' HG3' ' HG ' ' A' ' 16' ' ' LEU . 19.9 mmtt -70.02 -57.08 5.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.11 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 49' ' ' PHE . 7.7 ttm180 -98.75 32.49 2.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.634 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.405 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.0 ttp . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 120.964 0.412 . . . . 0.0 110.755 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.677 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.226 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.677 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.6 Cg_endo -53.22 -21.81 18.13 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.538 1.492 . . . . 0.0 110.971 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.551 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -50.97 -22.32 2.21 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.012 179.16 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.442 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -45.3 -58.07 3.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.25 0.547 . . . . 0.0 109.975 179.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.16 -36.72 29.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.726 178.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.88 -50.48 68.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.178 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.615 ' CD1' ' N ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -56.46 -48.23 77.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.395 179.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.615 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -75.22 -26.37 58.88 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.277 179.474 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.528 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -55.84 -58.92 5.83 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.49 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -63.4 -32.04 73.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.984 178.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.452 HG12 ' CZ ' ' A' ' 49' ' ' PHE . 44.4 t -57.97 -59.05 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.117 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.414 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 10.6 t80 -69.92 -12.79 61.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.409 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.528 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -83.7 -35.45 24.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.477 179.716 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -60.87 -38.56 86.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.213 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 9.6 ptmt -165.05 -149.3 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.399 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.5 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 32.8 mm-40 -144.25 -49.07 0.28 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.057 0.456 . . . . 0.0 111.749 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.6 t -77.75 68.72 3.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.651 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.432 ' CD2' ' CG ' ' A' ' 23' ' ' LYS . 1.7 mt -75.51 109.33 8.97 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.92 176.76 6.22 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.933 0.397 . . . . 0.0 111.235 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.446 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.3 m -45.48 -29.46 1.14 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.502 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.423 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 4.1 mmpt? -79.64 -45.32 19.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.039 0.447 . . . . 0.0 110.558 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.52 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.4 mt-10 -72.41 -35.93 68.5 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.717 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.531 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 24.1 pttt -62.02 -34.88 77.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.944 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -89.24 -36.35 15.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.403 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.423 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -74.65 -36.46 62.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.789 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.52 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 74.9 t -78.83 -38.09 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.359 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.653 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -62.4 -32.03 72.8 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.67 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -88.05 -20.66 25.46 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -25.93 13.08 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 73.2 m -98.7 -27.48 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.63 26.32 3.41 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.03 -1.081 . . . . 0.0 113.671 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.653 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -114.02 -163.65 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.932 0.366 . . . . 0.0 110.092 179.043 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.402 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -149.91 156.9 38.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.3 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -49.91 -24.87 11.12 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.647 2.231 . . . . 0.0 112.338 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.1 tp -89.61 -29.4 18.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.571 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.53 ' O ' ' N ' ' A' ' 48' ' ' TRP . 36.7 mm-40 -80.48 -58.62 3.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.807 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.534 HG11 ' HB1' ' A' ' 35' ' ' ALA . 26.4 m -36.35 -31.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.618 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.53 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.76 -50.68 7.38 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.041 179.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.499 HG21 ' HA ' ' A' ' 44' ' ' GLN . 25.5 m -75.58 -43.08 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.463 0.649 . . . . 0.0 110.732 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.53 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -63.21 -51.26 67.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.821 -179.618 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.518 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 22.2 m-30 -69.11 -18.04 63.92 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.549 0.214 . . . . 0.0 110.943 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -64.04 -59.33 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.535 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -75.28 -28.64 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.326 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.443 ' HG3' HD22 ' A' ' 16' ' ' LEU . 11.5 mmtp -84.57 -32.64 23.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.343 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -128.53 38.21 4.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.207 -179.608 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 ttm . . . . . 0 C--N 1.33 -0.252 0 CA-C-O 120.85 0.357 . . . . 0.0 110.831 179.748 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.671 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.308 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.671 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.7 Cg_endo -53.75 -22.42 23.1 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.581 1.521 . . . . 0.0 110.995 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.556 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -51.92 -23.69 5.31 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.851 179.162 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -45.7 -57.66 4.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.29 0.567 . . . . 0.0 110.087 179.108 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.82 -36.07 32.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.592 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.66 -53.55 39.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.525 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.58 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -55.5 -46.92 76.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.581 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.56 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -77.78 -25.18 48.88 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.354 179.558 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.541 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.6 mm-40 -55.64 -56.2 23.15 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.27 -33.96 76.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.947 178.692 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.47 ' HB ' ' HA ' ' A' ' 16' ' ' LEU . 41.9 t -55.18 -59.92 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.059 0.457 . . . . 0.0 109.797 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.497 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 25.1 t80 -71.06 -10.93 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.759 179.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.541 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -78.03 -42.35 32.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.073 0.463 . . . . 0.0 110.476 179.868 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.98 -45.3 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.78 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.463 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -153.15 -155.36 0.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.192 179.682 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.428 ' O ' ' CD ' ' A' ' 53' ' ' ARG . 20.2 mm-40 -140.31 -48.01 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.976 0.417 . . . . 0.0 111.456 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -82.29 78.17 8.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.457 -178.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.463 ' CD2' ' CG ' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -80.11 125.46 29.84 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.592 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.87 -177.93 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.735 0.302 . . . . 0.0 110.551 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 4.3 t -52.79 -26.16 13.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.142 0.496 . . . . 0.0 110.548 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.99 -48.55 14.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.682 179.608 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.9 mm-40 -72.23 -36.51 69.14 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.644 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.54 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 33.7 pttt -60.3 -35.49 75.71 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.023 0.439 . . . . 0.0 109.889 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.592 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.3 -35.82 66.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.871 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.516 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 90.4 t -79.95 -39.48 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.494 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.686 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -61.13 -31.66 71.36 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -87.48 -21.18 25.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.445 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 2.8 pttt -104.63 -26.06 12.48 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.624 -179.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 73.2 m -96.4 -27.49 14.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.258 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.79 21.9 4.85 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.71 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.686 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.26 -162.3 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.989 0.394 . . . . 0.0 110.22 179.146 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.401 ' HA ' ' HB2' ' A' ' 35' ' ' ALA . 0.2 OUTLIER -153.57 155.41 31.5 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.624 0.249 . . . . 0.0 110.812 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.4 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 79.0 Cg_exo -48.04 -27.09 8.5 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.593 2.195 . . . . 0.0 112.331 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 17.0 tp -89.06 -27.82 20.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.562 ' HA ' HG21 ' A' ' 47' ' ' VAL . 4.4 mm-40 -82.64 -57.51 3.3 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.782 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.529 HG12 ' HB1' ' A' ' 35' ' ' ALA . 19.1 m -36.12 -33.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.299 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.498 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -82.79 -53.53 5.82 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.901 179.579 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.562 HG21 ' HA ' ' A' ' 44' ' ' GLN . 19.8 m -69.9 -42.71 79.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 121.395 0.617 . . . . 0.0 110.777 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.522 ' CE3' ' CD1' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -64.35 -53.44 48.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.741 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.488 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 19.4 m-30 -67.76 -14.06 62.63 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.753 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.8 OUTLIER -67.38 -56.93 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.854 0.359 . . . . 0.0 110.379 179.817 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -73.26 -30.6 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.047 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.46 ' HG3' ' CD2' ' A' ' 16' ' ' LEU . 2.3 mmtp -82.47 -42.5 18.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.851 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.497 ' HG3' ' CE1' ' A' ' 20' ' ' PHE . 16.9 ttp85 -116.77 38.43 3.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.411 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.418 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-O 120.815 0.34 . . . . 0.0 111.005 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.859 0.362 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? 61.29 104.7 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.9 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.48 -74.06 0.59 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.47 103.52 0.72 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.908 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -162.49 90.67 1.32 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.837 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.87 -46.55 1.59 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.512 2.141 . . . . 0.0 112.271 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.2 mttm 54.92 31.29 15.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.041 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -116.03 83.1 0.33 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.352 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -146.9 93.42 2.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.857 0.361 . . . . 0.0 110.863 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 64.71 -78.59 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.073 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 52.3 p -164.08 -179.84 6.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.041 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 6.3 tt -112.2 168.66 4.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.895 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.632 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -54.31 -177.49 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.879 179.187 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.632 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.54 -22.87 13.46 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.565 1.51 . . . . 0.0 110.916 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 15' ' ' PHE . 26.7 mt-30 -49.36 -25.16 2.27 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.929 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.24 -56.08 5.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.228 0.537 . . . . 0.0 109.91 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.69 -36.19 28.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.679 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -65.73 -55.79 15.49 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.499 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.524 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -55.3 -52.4 63.56 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.491 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.487 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.6 tp -63.88 -34.25 77.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.987 178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.553 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -52.38 -65.01 0.63 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.316 179.584 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -60.73 -32.27 71.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.833 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.49 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 89.1 t -59.03 -67.26 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.466 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 28.8 t80 -60.85 -17.53 50.69 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.981 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.553 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.67 -38.22 54.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.88 0.372 . . . . 0.0 110.68 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -59.27 -38.92 81.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.443 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.479 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -170.16 -147.57 0.06 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.804 179.805 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.479 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.8 mm-40 -140.41 -51.96 0.48 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.179 0.514 . . . . 0.0 110.983 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.5 t -77.6 70.88 4.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.332 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.456 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.9 mt -74.08 106.38 5.73 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.401 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 4.0 p30 -87.48 178.19 6.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.824 0.345 . . . . 0.0 111.658 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.4 m -48.07 -29.29 3.43 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.445 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.421 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.7 mmpt? -77.63 -47.5 19.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.526 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 22.6 mt-10 -73.03 -35.73 66.81 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.945 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 3.1 pttt -61.45 -33.87 74.46 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.029 0.442 . . . . 0.0 109.908 179.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -90.49 -36.49 14.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.421 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.1 mm-40 -74.67 -35.57 62.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.526 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 81.9 t -78.96 -37.88 20.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.3 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.631 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -64.81 -30.19 71.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.098 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -87.34 -21.06 25.92 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.439 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.6 OUTLIER -103.51 -28.91 11.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.636 0.255 . . . . 0.0 111.428 -179.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 78.9 m -92.71 -27.84 17.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.289 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.92 24.29 4.95 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.377 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.631 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.97 -163.91 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.025 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.41 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -150.27 156.5 37.29 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.761 0.315 . . . . 0.0 111.148 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.431 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 75.1 Cg_exo -49.65 -24.9 10.27 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.687 2.258 . . . . 0.0 112.292 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.2 OUTLIER -90.0 -27.71 19.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.608 179.775 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.521 ' O ' ' N ' ' A' ' 48' ' ' TRP . 33.0 mm-40 -82.57 -58.27 2.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.843 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.539 HG11 ' HB3' ' A' ' 35' ' ' ALA . 24.9 m -36.67 -32.61 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.282 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.506 ' O ' HG12 ' A' ' 50' ' ' ILE . 1.1 ptp85 -82.37 -60.57 2.16 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.76 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 44' ' ' GLN . 17.2 m -67.87 -44.58 85.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.329 0.585 . . . . 0.0 111.33 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.521 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -60.85 -52.83 63.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.797 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.536 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 18.2 m-30 -64.85 -28.0 69.26 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.714 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.8 mm -53.89 -51.67 42.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.66 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -80.13 -30.65 39.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.695 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.43 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 14.6 mmtt -94.94 18.78 11.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.103 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 49' ' ' PHE . 3.6 ttm105 -179.84 33.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.077 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.4 ttt -52.92 88.33 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.882 0.373 . . . . 0.0 110.851 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -80.26 -60.57 2.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.942 -179.65 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.15 -69.49 0.86 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.003 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.898 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.782 0.325 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.59 145.84 35.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -79.72 176.68 9.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.806 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -75.92 166.42 23.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.404 ' CB ' ' CD ' ' A' ' 2' ' ' PRO . 1.2 t -175.78 -61.99 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.604 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.404 ' CD ' ' CB ' ' A' ' 1' ' ' SER . 73.1 Cg_endo -75.14 59.85 5.39 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.524 2.15 . . . . 0.0 112.135 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -129.67 105.67 8.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.984 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.33 30.6 58.54 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.731 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -177.38 151.85 0.8 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.833 0.349 . . . . 0.0 110.785 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.8 m -67.71 -80.92 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.77 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.8 m 47.42 -167.04 0.02 OUTLIER 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.107 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.1 tt -177.72 167.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.016 0.436 . . . . 0.0 111.07 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.647 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -55.15 -176.68 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.984 179.244 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.647 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.87 -24.45 13.67 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 121.643 1.562 . . . . 0.0 110.964 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.55 ' O ' ' N ' ' A' ' 15' ' ' PHE . 29.2 mt-30 -47.63 -27.36 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.699 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.38 -55.85 3.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.184 0.516 . . . . 0.0 110.038 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.66 -36.44 28.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 178.843 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.06 -56.01 15.52 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.643 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.55 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -56.11 -50.71 70.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.562 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.471 ' N ' ' CG ' ' A' ' 15' ' ' PHE . 2.1 tp -65.5 -31.71 72.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.918 178.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.454 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 4.0 mt-10 -56.33 -56.15 24.68 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.393 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.436 ' HA ' ' HD3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.48 -24.39 62.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.997 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.474 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 89.5 t -73.08 -64.22 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.01 0.433 . . . . 0.0 110.951 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.438 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 21.4 t80 -61.82 -17.67 57.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.902 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 1.0 OUTLIER -79.53 -38.49 34.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.518 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -59.27 -38.55 80.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.0 ptmt -169.95 -145.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.564 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.518 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 21.5 mm-40 -144.59 -50.04 0.27 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.997 0.427 . . . . 0.0 111.412 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -81.82 71.88 8.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.417 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.49 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 1.5 mt -73.3 108.94 6.46 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -85.03 176.38 8.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.757 0.313 . . . . 0.0 111.06 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.5 m -45.9 -29.96 1.57 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.417 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.1 mmpt? -77.65 -48.74 16.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.842 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.504 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 15.5 mt-10 -70.79 -38.82 73.37 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.892 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.528 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 2.6 pttt -59.58 -34.33 72.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.017 0.436 . . . . 0.0 110.127 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -90.66 -37.42 13.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.633 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -73.51 -34.53 65.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.553 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 89.5 t -80.74 -38.8 17.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.402 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.605 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -63.4 -31.13 72.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.916 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -87.58 -19.95 27.11 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.02 -24.87 12.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.643 0.259 . . . . 0.0 111.551 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.0 m -97.5 -26.67 14.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.291 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.87 25.41 4.53 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.407 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.605 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -112.55 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.085 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.94 157.15 40.61 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.401 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 78.4 Cg_exo -50.41 -24.53 12.28 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.663 2.242 . . . . 0.0 112.269 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.435 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.3 tp -89.9 -28.13 19.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.731 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.532 ' O ' ' N ' ' A' ' 48' ' ' TRP . 35.8 mm-40 -81.5 -57.98 3.23 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.126 0.488 . . . . 0.0 109.823 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.542 HG12 ' HB1' ' A' ' 35' ' ' ALA . 19.7 m -36.32 -32.82 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.615 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.481 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -83.78 -57.98 2.99 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.8 179.665 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.463 HG21 ' HA ' ' A' ' 44' ' ' GLN . 21.6 m -68.66 -43.55 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 111.218 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.532 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -62.66 -53.91 47.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.018 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.5 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 19.1 m-30 -64.36 -28.9 70.01 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.427 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.2 -52.87 26.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.913 0.387 . . . . 0.0 110.599 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -79.0 -30.59 44.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.638 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.452 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 49.7 mmtt -93.89 19.19 9.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.924 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 29.2 ttp180 -177.5 31.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.976 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.54 86.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.902 0.382 . . . . 0.0 110.877 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.9 mmp_? -71.13 -43.68 67.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.713 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.3 t -73.99 123.13 23.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.896 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.5 ttpt . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.953 -179.925 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 14.2 tttm . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.887 0.375 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt -132.1 38.64 3.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.983 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -154.18 104.48 2.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.874 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.84 24.92 8.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.08 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 58.97 161.67 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.929 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.96 84.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.598 2.198 . . . . 0.0 112.158 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.6 tttp -170.19 146.88 3.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.852 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -161.95 59.79 0.29 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.374 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.6 mttt -141.46 -58.13 0.48 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.819 0.343 . . . . 0.0 110.931 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 91.5 p -127.65 -175.18 3.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.99 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.62 -69.15 0.83 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.944 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.411 HG21 ' CB ' ' A' ' 12' ' ' ALA . 6.3 tt -115.47 165.85 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.164 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.668 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.97 -175.45 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.07 179.419 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.668 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.9 Cg_endo -51.95 -23.29 16.25 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.759 1.639 . . . . 0.0 111.177 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.47 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -51.2 -23.44 3.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.137 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.411 ' CB ' HG21 ' A' ' 8' ' ' ILE . . . -47.69 -57.05 6.0 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.2 0.524 . . . . 0.0 109.852 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -80.99 -34.66 32.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.554 178.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.16 -56.47 12.7 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.239 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.522 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -53.03 -51.16 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.903 179.595 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.463 ' N ' ' CG ' ' A' ' 15' ' ' PHE . 1.6 tp -68.53 -31.77 71.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.309 178.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.661 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.0 mt-10 -52.47 -57.72 8.99 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.318 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.77 -35.99 77.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.899 179.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.484 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 86.6 t -58.52 -64.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-O 120.911 0.386 . . . . 0.0 110.137 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.412 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 63.2 t80 -60.72 -16.19 37.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.169 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.661 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -78.9 -39.21 35.57 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 110.805 179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.5 mtp85 -59.54 -40.34 86.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.884 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.488 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -163.33 -147.87 0.12 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.935 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.412 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 30.2 mm-40 -139.05 -49.43 0.51 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.436 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -99.19 91.17 4.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.067 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.503 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 1.8 mt -78.91 136.74 37.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.101 178.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.72 175.8 6.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.243 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.1 m -51.54 -26.12 7.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.467 . . . . 0.0 110.878 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.426 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -80.01 -47.5 14.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.582 179.673 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.499 ' O ' ' N ' ' A' ' 34' ' ' VAL . 2.9 mm-40 -71.63 -37.73 70.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.633 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.549 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 11.9 pttm -60.29 -35.77 76.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.77 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -89.0 -36.17 15.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.701 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.426 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 8.8 mm-40 -75.18 -36.09 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.728 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.499 ' N ' ' O ' ' A' ' 30' ' ' GLU . 82.1 t -78.24 -39.37 24.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.01 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.628 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -63.09 -30.41 71.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.98 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -87.58 -20.52 26.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 20.2 ptmt -105.07 -26.08 12.26 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.466 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -94.79 -28.2 15.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.101 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.09 23.57 4.85 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.309 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.628 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.78 -162.59 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.113 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.43 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -151.8 153.95 32.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.858 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.408 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 85.7 Cg_exo -47.28 -26.31 5.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.713 2.275 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 8.8 tp -88.05 -28.56 21.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.658 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' TRP . 34.8 mm-40 -81.74 -58.14 3.13 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.068 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.531 HG11 ' HB1' ' A' ' 35' ' ' ALA . 21.3 m -36.27 -33.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.395 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.499 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -82.05 -58.75 2.83 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.792 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.477 HG22 ' HA ' ' A' ' 44' ' ' GLN . 24.3 m -67.82 -43.66 86.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.271 0.558 . . . . 0.0 111.278 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.77 -54.23 45.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.018 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.518 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 19.8 m-30 -63.7 -29.34 70.58 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 120.674 0.273 . . . . 0.0 110.6 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.4 mm -52.28 -56.06 8.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.747 0.308 . . . . 0.0 110.912 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -77.76 -31.16 51.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.427 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 52.8 mmtt -90.11 11.63 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.133 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' A' ' 49' ' ' PHE . 9.5 ttp180 -170.57 32.35 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.165 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.51 84.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.965 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 53' ' ' ARG . 8.4 mmp_? -69.24 -41.28 77.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.993 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.8 -169.34 1.99 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.139 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.055 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 3.2 tptt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.877 0.37 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.6 36.25 1.68 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.963 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -169.78 -169.15 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.964 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.84 99.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.6 m -127.87 91.39 45.2 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.953 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.21 148.25 68.2 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.514 2.143 . . . . 0.0 112.298 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt 63.35 126.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.992 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.01 -79.37 0.25 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.528 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.9 83.13 7.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.896 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.9 t -150.45 135.36 17.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.87 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.7 t -75.04 145.26 42.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.946 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 6.9 tt -66.03 169.33 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.648 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.64 -176.9 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.96 179.261 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.648 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.37 -23.9 14.87 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.684 1.589 . . . . 0.0 110.985 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.561 ' O ' ' N ' ' A' ' 15' ' ' PHE . 27.8 mt-30 -49.35 -26.62 3.28 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.832 179.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.08 -55.84 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.338 0.59 . . . . 0.0 110.038 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.402 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -81.49 -36.56 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.612 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -65.7 -57.53 7.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.581 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.561 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -54.31 -52.02 62.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.005 179.72 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.463 ' N ' ' CG ' ' A' ' 15' ' ' PHE . 2.0 tp -64.95 -34.58 78.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.568 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.32 -64.12 0.91 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.362 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -62.75 -34.54 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.974 179.699 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.489 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 74.9 t -58.58 -65.5 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-O 120.816 0.341 . . . . 0.0 110.137 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -61.34 -15.54 36.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.21 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.94 -36.27 28.19 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 120.899 0.38 . . . . 0.0 111.063 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -58.87 -37.87 77.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.587 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.451 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.0 ptmt -163.19 -138.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.331 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.441 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 19.5 mm-40 -147.9 -46.5 0.16 Allowed 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.516 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.1 t -100.36 82.92 2.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.496 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 5.0 mt -74.95 125.04 28.04 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 176.31 6.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.749 0.309 . . . . 0.0 110.951 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.1 t -45.88 -29.82 1.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.142 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.0 mmpt? -78.19 -48.06 16.7 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.515 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' A' ' 34' ' ' VAL . 3.7 mt-10 -70.1 -40.15 75.11 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 7.3 pttt -58.76 -34.63 71.62 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.16 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.08 -37.01 14.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.678 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -73.88 -34.71 64.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.583 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.513 ' N ' ' O ' ' A' ' 30' ' ' GLU . 82.4 t -80.29 -38.07 17.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.327 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.591 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -65.31 -30.9 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.935 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -87.61 -19.22 28.08 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -25.27 13.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 0.0 111.574 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 56.9 m -96.99 -30.22 13.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.064 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.04 22.58 4.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.208 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.591 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -107.05 -163.26 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.98 155.54 37.81 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.674 0.273 . . . . 0.0 111.081 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.415 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 73.5 Cg_exo -48.79 -29.41 14.77 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.499 2.133 . . . . 0.0 112.037 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.434 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 22.5 tp -84.32 -26.93 28.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.683 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.497 ' O ' ' N ' ' A' ' 48' ' ' TRP . 5.6 mm-40 -83.35 -59.19 2.54 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.562 HG11 ' HB3' ' A' ' 35' ' ' ALA . 19.6 m -36.25 -33.89 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.112 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.513 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -80.68 -58.77 2.95 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.934 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.47 HG23 ' HA ' ' A' ' 44' ' ' GLN . 21.9 m -69.0 -44.28 81.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.361 0.6 . . . . 0.0 111.344 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.497 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.45 -52.8 63.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.023 -179.424 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.513 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 21.6 m-30 -66.79 -24.76 66.23 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.715 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.513 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -55.51 -53.95 30.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.872 0.368 . . . . 0.0 110.369 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -80.83 -30.09 35.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.626 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.447 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 63.3 mmtt -93.23 14.94 16.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.021 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.545 ' O ' ' N ' ' A' ' 55' ' ' ARG . 6.5 ttp180 -178.14 36.37 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.167 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.87 69.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.051 0.453 . . . . 0.0 110.299 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.545 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.4 OUTLIER -72.47 -54.07 10.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.061 -179.498 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -84.21 171.19 12.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.947 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.843 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 14.0 tptt . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.748 0.309 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 13.4 mttt 63.5 -78.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.06 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 55.41 34.5 23.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.998 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -108.95 59.82 0.6 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.819 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.422 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -61.81 -61.82 7.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.12 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 1' ' ' SER . 27.2 Cg_endo -62.23 168.03 10.02 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.263 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt 61.99 36.38 15.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.865 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.02 -159.35 28.06 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.41 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -147.85 106.52 3.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.803 0.335 . . . . 0.0 110.862 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -117.34 -2.68 11.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.335 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t 61.83 161.83 0.07 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.844 0.354 . . . . 0.0 110.968 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 6.2 tt -119.06 168.73 10.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.926 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.65 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.21 -176.74 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.973 179.167 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.65 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.1 Cg_endo -51.73 -23.08 14.72 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.678 1.585 . . . . 0.0 110.999 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.554 ' O ' ' N ' ' A' ' 15' ' ' PHE . 27.9 mt-30 -49.85 -25.31 3.03 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.865 179.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.4 -56.23 4.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.313 0.578 . . . . 0.0 109.877 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 2.6 ptt85 -81.37 -37.64 27.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.564 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.57 -56.83 12.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.554 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -54.03 -51.45 63.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.033 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.478 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.8 tp -64.46 -34.18 77.61 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.562 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.4 -67.08 0.28 Allowed 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.148 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -35.69 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.073 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.458 HG13 ' CZ ' ' A' ' 49' ' ' PHE . 71.8 t -56.14 -67.73 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.932 0.396 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.41 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 46.7 t80 -61.26 -15.93 40.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.372 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.562 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.07 -37.75 28.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.861 0.363 . . . . 0.0 111.005 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.9 mtp-105 -59.99 -37.52 79.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.637 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.429 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.48 -150.35 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.318 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.41 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 32.0 mm-40 -141.68 -46.48 0.36 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.987 0.423 . . . . 0.0 111.489 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.1 t -84.55 77.85 9.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.244 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.479 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 2.0 mt -80.67 109.86 15.62 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -97.49 -176.12 3.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.301 . . . . 0.0 111.317 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.436 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.5 m -48.55 -30.9 5.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.42 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.4 mmpt? -77.0 -48.49 17.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.685 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.0 mm-40 -70.69 -39.15 73.66 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.984 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 34.6 pttt -58.44 -34.44 70.83 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.089 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -91.82 -36.69 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.736 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.428 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -74.21 -35.38 63.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.646 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.509 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 91.0 t -79.97 -39.86 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.598 ' HB1' HG11 ' A' ' 45' ' ' VAL . . . -62.75 -30.04 71.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.099 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.41 -19.82 27.54 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.422 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -106.69 -21.74 12.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.632 0.253 . . . . 0.0 111.518 -179.467 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 71.6 m -99.31 -26.62 14.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.259 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.57 26.25 4.58 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.329 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.588 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -112.57 -167.92 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.262 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.04 155.68 62.11 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 111.076 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.26 -25.13 12.81 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.616 2.211 . . . . 0.0 112.28 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -89.22 -26.28 21.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.626 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.535 ' O ' ' N ' ' A' ' 48' ' ' TRP . 29.4 mm-40 -82.26 -58.83 2.77 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.598 HG11 ' HB1' ' A' ' 35' ' ' ALA . 19.3 m -36.62 -33.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.404 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.498 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.43 -59.48 2.61 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.681 179.576 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.43 ' CG2' ' N ' ' A' ' 48' ' ' TRP . 20.4 m -69.21 -44.32 80.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.285 0.565 . . . . 0.0 111.379 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.535 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.43 -51.99 66.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.065 -179.447 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.512 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 20.7 m-30 -67.05 -27.3 67.28 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.674 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.44 -53.88 21.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.584 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -79.92 -29.52 39.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.432 ' HG3' HD12 ' A' ' 16' ' ' LEU . 63.5 mmtt -93.57 17.41 11.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 49' ' ' PHE . 22.7 ttp180 -178.18 32.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.193 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.4 ttm -51.23 89.17 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.931 0.396 . . . . 0.0 111.069 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 53' ' ' ARG . 8.6 mmt180 -72.4 -50.79 23.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.823 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.53 -71.19 0.35 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.78 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.4 tttm . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.868 179.955 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.829 0.347 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.0 58.97 5.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.898 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -105.33 -35.9 7.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.908 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -97.92 38.67 1.28 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.885 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.3 p -98.3 122.4 54.04 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.812 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.45 -53.04 7.26 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.422 2.081 . . . . 0.0 112.314 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.11 -76.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.6 -115.99 5.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.445 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -60.28 123.71 18.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.803 0.335 . . . . 0.0 110.874 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.2 t -98.18 125.36 43.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.01 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.6 t -166.66 96.62 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.622 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.4 tt -94.83 169.75 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.427 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -60.45 -174.77 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.485 179.203 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.9 Cg_endo -49.8 -24.04 9.47 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.692 1.595 . . . . 0.0 110.998 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.565 ' O ' ' N ' ' A' ' 15' ' ' PHE . 28.4 mt-30 -46.46 -27.62 1.14 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.91 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.25 -57.06 3.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 110.074 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.413 ' O ' ' N ' ' A' ' 17' ' ' GLU . 1.2 ptm180 -81.13 -35.43 31.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.771 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -65.8 -56.59 11.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 120.985 0.421 . . . . 0.0 111.145 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.565 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -52.63 -50.09 63.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.879 179.353 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.535 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -67.93 -36.21 79.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.801 178.825 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.615 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.7 mt-10 -48.21 -60.54 2.56 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.157 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -65.11 -35.01 79.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.264 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.477 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 87.8 t -58.12 -65.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 110.035 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.428 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 19.3 t80 -60.72 -17.83 50.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.949 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.615 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.8 -38.87 53.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.952 0.405 . . . . 0.0 110.84 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.38 -41.79 90.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.644 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -164.23 -144.59 0.08 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.631 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.518 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 20.2 mm-40 -145.45 -48.47 0.23 Allowed 'General case' 0 C--N 1.334 -0.081 0 CA-C-O 120.881 0.372 . . . . 0.0 111.563 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.3 t -86.01 73.36 10.31 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.487 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 2.3 mt -73.16 113.45 10.23 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -88.2 178.13 6.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.736 0.303 . . . . 0.0 110.99 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -47.44 -28.68 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.001 0.429 . . . . 0.0 111.045 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.0 OUTLIER -77.1 -50.62 12.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.914 179.883 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.508 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 8.7 mt-10 -70.56 -38.9 74.19 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.82 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.543 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 19.7 pttt -59.05 -34.89 72.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.151 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -90.5 -37.6 13.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.699 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.04 -34.28 66.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.633 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.508 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 92.7 t -81.75 -38.66 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.629 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.63 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -62.73 -33.72 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.992 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.8 pttm -87.58 -18.83 28.81 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -25.67 13.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.667 0.27 . . . . 0.0 111.44 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 76.8 m -98.51 -29.57 13.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.138 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.28 22.96 3.97 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.415 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.63 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -110.08 -163.77 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 179.12 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.408 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -148.98 154.45 39.69 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.788 0.328 . . . . 0.0 110.984 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -47.98 -27.61 9.08 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.61 2.206 . . . . 0.0 112.289 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.442 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.1 tp -85.83 -28.3 24.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.693 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.536 ' O ' ' N ' ' A' ' 48' ' ' TRP . 37.5 mm-40 -82.06 -58.84 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.899 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.535 HG12 ' HB1' ' A' ' 35' ' ' ALA . 20.9 m -35.94 -33.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.375 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.524 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -82.29 -56.87 3.65 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.05 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.467 HG23 ' HA ' ' A' ' 44' ' ' GLN . 21.5 m -71.55 -43.79 71.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.254 0.55 . . . . 0.0 111.301 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.536 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.61 -55.03 35.09 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.716 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.512 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 19.5 m-30 -62.71 -22.52 66.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 120.722 0.296 . . . . 0.0 110.443 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -64.48 -52.01 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.166 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -79.82 -34.59 39.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.05 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.499 ' HG2' ' CZ3' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -80.27 -26.5 38.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.132 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.49 ' O ' ' N ' ' A' ' 55' ' ' ARG . 8.6 ttm180 -133.24 35.39 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.718 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 4.3 ttm -54.84 84.79 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.744 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -73.15 -46.55 50.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.94 -179.563 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.61 -170.75 3.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.945 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.1 mttm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.889 -179.993 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 2.3 pttt . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.757 0.313 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -93.31 125.22 37.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -88.94 5.75 42.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.394 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 4.3 mttp 63.22 135.33 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.824 0.345 . . . . 0.0 110.936 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.1 t -61.51 -60.86 9.15 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.899 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.59 139.89 41.93 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.454 2.103 . . . . 0.0 112.315 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -169.25 -45.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.836 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.98 150.94 21.14 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.538 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.1 pttm -107.29 -178.65 3.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.865 0.364 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.5 t 61.36 93.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.904 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 58.67 -175.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.002 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.6 tt -134.67 167.85 24.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.993 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.648 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -54.68 -177.02 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.051 179.292 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.648 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.5 Cg_endo -50.52 -24.32 12.27 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.821 1.681 . . . . 0.0 110.876 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 15' ' ' PHE . 28.3 mt-30 -48.46 -25.71 1.79 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.87 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.63 -55.27 5.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 0.0 109.935 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -81.93 -37.11 27.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.861 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -64.83 -55.08 21.75 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.506 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.506 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -55.31 -51.88 65.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.014 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.485 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.8 tp -66.05 -33.56 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.632 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.7 mm-40 -51.29 -64.47 0.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -61.34 -36.4 80.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.481 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.477 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 93.4 t -58.52 -66.85 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.417 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 65.6 t80 -59.51 -18.24 38.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.818 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.632 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -75.39 -39.8 58.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.982 0.42 . . . . 0.0 110.618 179.796 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.0 mtp180 -59.52 -40.0 85.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.706 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.5 ptmt -168.89 -144.75 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.427 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.518 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.5 mm-40 -144.58 -50.25 0.27 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 111.38 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.8 t -85.83 74.39 10.2 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.485 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 2.9 mt -72.75 129.4 38.11 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.48 -179.65 4.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.753 0.311 . . . . 0.0 110.655 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.0 m -52.21 -26.94 12.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.19 0.519 . . . . 0.0 110.262 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.44 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.14 -50.23 12.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.61 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' O ' ' N ' ' A' ' 34' ' ' VAL . 1.6 mt-10 -70.67 -39.37 73.6 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.815 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 3.3 pttp -59.0 -34.88 72.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.224 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -90.31 -37.85 13.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.578 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.44 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 5.0 mm-40 -73.13 -35.62 66.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.621 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.507 ' N ' ' O ' ' A' ' 30' ' ' GLU . 94.3 t -79.63 -38.5 19.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.163 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.612 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -63.32 -33.42 75.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.336 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -88.22 -19.95 26.17 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.404 ' CG ' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -101.91 -28.84 12.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.62 -179.111 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 71.4 m -95.9 -29.36 14.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.154 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.94 26.88 2.89 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.344 -0.932 . . . . 0.0 113.579 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.612 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -113.1 -161.91 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.053 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.445 ' CG2' ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -149.99 151.25 31.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.495 0.188 . . . . 0.0 110.704 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.445 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 4.7 Cg_endo -47.12 -27.42 6.31 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.83 2.354 . . . . 0.0 112.195 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 10.5 tp -84.81 -28.74 25.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.525 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 48' ' ' TRP . 38.8 mm-40 -81.74 -58.1 3.15 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.84 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.552 HG12 ' HB3' ' A' ' 35' ' ' ALA . 20.2 m -36.2 -33.16 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.581 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.502 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -83.31 -55.85 4.09 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.831 179.662 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' A' ' 44' ' ' GLN . 28.7 m -70.8 -44.03 76.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.344 0.593 . . . . 0.0 111.368 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.502 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -62.15 -53.24 58.2 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.124 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.506 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 19.8 m-30 -65.48 -27.41 68.48 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.699 0.285 . . . . 0.0 110.601 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.502 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -54.59 -55.17 16.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.804 0.335 . . . . 0.0 110.763 -179.775 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -79.53 -29.97 41.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.716 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.414 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 23.5 mmtt -90.24 10.53 24.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.15 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.522 ' O ' ' N ' ' A' ' 55' ' ' ARG . 12.1 ttp180 -170.38 32.27 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.491 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -51.64 85.77 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.97 0.414 . . . . 0.0 110.76 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.2 mmp_? -76.41 -35.93 58.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.223 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 t -45.25 -54.9 6.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.419 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.9 tttp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.814 179.891 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.898 0.38 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.95 116.97 32.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.968 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 58.96 -171.3 0.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.003 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -78.83 -41.23 30.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.888 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.409 ' CB ' ' HD3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -177.38 -57.14 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.982 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.409 ' HD3' ' CB ' ' A' ' 1' ' ' SER . 84.0 Cg_exo -47.2 125.79 10.81 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.527 2.152 . . . . 0.0 112.445 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.36 78.82 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.707 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.2 133.53 8.01 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.34 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.65 126.19 30.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.818 0.342 . . . . 0.0 111.084 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.8 m -67.61 160.88 26.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.703 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 m -135.29 82.39 1.95 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.076 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.4 tt -159.58 165.41 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.973 0.416 . . . . 0.0 111.391 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.72 -175.48 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.082 179.408 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.4 Cg_endo -50.87 -24.42 13.58 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.846 1.697 . . . . 0.0 110.965 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.5 ' O ' ' N ' ' A' ' 15' ' ' PHE . 1.1 mt-30 -49.95 -23.47 2.01 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.031 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.19 -55.8 7.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.143 0.497 . . . . 0.0 109.948 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -81.26 -35.31 31.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.635 178.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.5 -55.29 18.7 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.168 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.524 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -53.08 -50.84 63.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.841 179.526 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.478 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.2 tp -69.14 -32.24 71.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.651 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -51.47 -56.98 10.33 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.117 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -69.38 -34.31 74.35 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.717 179.417 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.484 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 90.7 t -58.54 -67.03 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.843 0.354 . . . . 0.0 110.046 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.404 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 23.8 t80 -59.1 -16.91 21.86 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.951 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.651 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.91 -40.5 47.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.028 0.442 . . . . 0.0 111.046 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.8 -38.82 79.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.035 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.476 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -166.27 -139.58 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.467 179.649 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.476 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 16.0 mm-40 -148.27 -46.88 0.16 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.917 0.389 . . . . 0.0 111.362 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.415 ' HA ' ' CZ ' ' A' ' 53' ' ' ARG . 20.8 t -93.61 78.27 4.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.328 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.51 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 4.5 mt -74.13 121.36 21.04 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -90.36 177.02 6.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.745 0.307 . . . . 0.0 110.879 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -48.25 -28.19 2.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.952 0.406 . . . . 0.0 111.071 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 5.6 mmpt? -78.36 -48.4 15.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.635 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.524 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 5.2 mt-10 -70.96 -37.78 72.81 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.884 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.535 ' O ' ' HB1' ' A' ' 35' ' ' ALA . 35.2 pttt -60.3 -34.82 74.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.038 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -90.06 -37.45 14.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.549 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 9.6 mm-40 -73.47 -35.41 65.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.642 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.524 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 86.3 t -80.09 -37.76 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.295 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.608 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -64.5 -32.02 73.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.477 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.6 ptmt -87.7 -19.34 27.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.328 -0.396 . . . . 0.0 112.032 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.59 -27.37 12.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.624 0.249 . . . . 0.0 111.492 -179.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 77.8 m -96.64 -29.0 14.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.24 24.88 4.0 Favored Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.306 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.608 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -110.4 -165.43 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.06 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.439 ' CG2' ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -146.27 151.77 44.98 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 120.573 0.225 . . . . 0.0 110.624 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.439 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 4.8 Cg_endo -46.9 -29.1 7.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.745 2.296 . . . . 0.0 112.148 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 31.7 tp -82.42 -29.31 30.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.589 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.517 ' O ' ' N ' ' A' ' 48' ' ' TRP . 36.4 mm-40 -81.44 -58.91 2.82 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.897 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.554 HG13 ' HB2' ' A' ' 35' ' ' ALA . 21.2 m -35.89 -33.39 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.483 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.529 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -82.56 -56.38 3.9 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.793 179.609 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.482 HG23 ' HA ' ' A' ' 44' ' ' GLN . 27.5 m -69.84 -43.3 79.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.402 0.62 . . . . 0.0 111.117 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.517 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -62.32 -53.78 50.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.982 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.575 ' O ' ' HB3' ' A' ' 53' ' ' ARG . 20.6 m-30 -66.55 -20.49 66.03 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.657 0.265 . . . . 0.0 110.741 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -59.85 -59.99 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.181 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -72.94 -43.1 62.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.406 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.438 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 43.5 mmtt -71.18 -33.64 70.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.595 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 2.3 tmt_? -123.13 34.59 5.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.471 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 4.9 ttp -57.21 83.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.916 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.46 ' N ' ' O ' ' A' ' 53' ' ' ARG . 7.8 mmp_? -65.07 -40.11 94.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.646 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.84 160.86 17.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.819 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.962 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.844 0.354 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 0' ' ' LYS . 2.0 mttt -139.07 -45.59 0.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.018 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 44.67 -91.09 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.534 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' -2' ' ' LYS . 0.0 OUTLIER -95.48 -179.29 4.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.745 0.307 . . . . 0.0 110.884 179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.437 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -178.37 -61.9 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.118 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.437 ' HD2' ' N ' ' A' ' 1' ' ' SER . 16.1 Cg_endo -57.45 178.25 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.52 2.146 . . . . 0.0 112.342 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.19 94.69 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.929 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -150.8 58.34 0.44 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.529 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -130.44 140.45 50.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.778 0.323 . . . . 0.0 110.926 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 38.5 t 59.67 61.43 1.96 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.3 m -110.11 -25.96 9.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.08 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 11.3 tt -149.58 166.1 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.289 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.681 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -52.17 -175.23 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.453 179.364 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.7 Cg_endo -50.39 -25.02 13.04 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 121.78 1.654 . . . . 0.0 111.082 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.441 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -50.79 -23.67 2.91 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.79 179.115 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.89 -54.51 12.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.157 0.503 . . . . 0.0 109.814 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -36.52 27.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.723 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 17' ' ' GLU . . . -65.22 -54.06 35.11 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.574 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.505 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -58.03 -52.5 65.26 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.486 ' N ' ' CG ' ' A' ' 15' ' ' PHE . 2.5 tp -63.25 -32.58 74.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.81 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.494 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -53.66 -66.59 0.37 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.097 179.332 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -27.42 66.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.476 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 98.0 t -70.69 -63.28 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.06 0.457 . . . . 0.0 110.731 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.406 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 61.0 t80 -68.42 -11.51 59.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.544 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.494 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -85.73 -36.62 20.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.57 -179.688 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.229 0.538 . . . . 0.0 110.218 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.464 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -162.37 -143.1 0.08 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.951 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.406 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 20.1 mm-40 -147.07 -44.82 0.18 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.543 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -101.54 90.39 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.495 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 6.7 mt -86.0 130.54 34.51 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.413 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 3.2 p30 -95.48 -176.65 3.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 11.3 t -52.13 -29.26 21.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.31 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.02 -47.74 17.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.6 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 23.9 mt-10 -72.05 -36.99 69.76 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.818 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.516 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 4.3 pttp -60.89 -34.24 74.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.02 0.438 . . . . 0.0 109.947 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -90.02 -36.39 14.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.534 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -74.94 -35.11 62.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.59 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 93.3 t -80.12 -36.78 16.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.589 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -65.84 -29.64 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.503 . . . . 0.0 112.078 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -87.23 -19.92 27.66 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 5.3 ptmm? -103.93 -26.85 12.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.686 0.279 . . . . 0.0 111.513 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 61.2 m -95.21 -27.72 15.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 113.24 24.72 4.68 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.321 -0.943 . . . . 0.0 113.404 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.589 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.55 -165.36 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.163 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.52 158.02 47.43 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 120.769 0.318 . . . . 0.0 111.203 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.413 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 56.6 Cg_exo -51.61 -23.76 15.79 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.647 2.231 . . . . 0.0 112.374 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.2 tp -91.6 -25.51 19.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.745 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.537 ' O ' ' N ' ' A' ' 48' ' ' TRP . 36.4 mm-40 -82.99 -58.54 2.82 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 109.882 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.57 HG12 ' HB1' ' A' ' 35' ' ' ALA . 20.7 m -36.53 -33.23 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.218 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.497 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.75 -59.74 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.767 179.563 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.456 HG21 ' HA ' ' A' ' 44' ' ' GLN . 20.6 m -68.53 -44.06 83.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.224 0.535 . . . . 0.0 111.38 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.537 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.41 -54.05 48.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.962 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.514 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 20.8 m-30 -64.23 -29.61 70.71 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.458 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.497 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -52.84 -51.68 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.908 0.385 . . . . 0.0 110.573 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -79.63 -29.52 41.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.548 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.464 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 52.6 mmtt -94.84 18.36 11.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.9 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' PHE . 12.6 ttp180 -176.27 30.63 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.32 88.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.866 0.365 . . . . 0.0 110.99 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.1 mmp_? -69.1 -41.83 76.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.792 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.62 137.78 41.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.906 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.926 179.947 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.881 0.372 . . . . 0.0 111.184 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.83 54.5 3.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.049 0.452 . . . . 0.0 110.809 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -126.41 175.14 8.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.988 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 11.3 tptt 60.54 19.96 9.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.13 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -61.67 0.38 Allowed Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.255 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.21 -44.4 1.79 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.345 2.03 . . . . 0.0 112.424 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -58.28 130.6 47.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.88 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 140.99 -118.49 1.39 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.423 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt 61.91 -163.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.785 0.326 . . . . 0.0 110.905 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 70.67 -79.76 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.906 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 48.83 91.57 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.044 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 6.5 tt -59.43 168.67 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.215 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.665 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.14 -175.7 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.053 179.146 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.665 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.1 Cg_endo -52.92 -22.81 19.28 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 121.589 1.526 . . . . 0.0 111.028 179.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.529 ' O ' ' N ' ' A' ' 15' ' ' PHE . 28.0 mt-30 -49.76 -26.95 4.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.547 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.46 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -41.66 -59.68 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.249 0.547 . . . . 0.0 110.121 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -81.51 -35.21 30.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.701 178.842 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.2 -57.73 8.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.234 -179.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.61 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -55.35 -45.06 76.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.504 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.562 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -69.9 -31.69 69.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.911 179.123 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.6 OUTLIER -54.36 -64.61 0.78 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.581 179.049 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -32.33 69.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.304 178.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.455 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 25.0 t -59.02 -57.24 12.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.991 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.411 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 9.0 t80 -73.41 -11.8 60.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.739 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.13 -37.4 28.91 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.504 179.665 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -60.24 -42.1 94.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.335 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.443 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -160.64 -155.3 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.473 179.746 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.409 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 29.2 mm-40 -139.72 -47.99 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 111.551 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 t -77.9 73.77 4.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.455 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.443 ' CD2' ' HG3' ' A' ' 23' ' ' LYS . 0.7 OUTLIER -80.32 115.72 20.01 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.502 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.59 -177.26 3.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.732 0.301 . . . . 0.0 110.626 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.401 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 0.9 OUTLIER -52.1 -26.48 11.26 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.147 0.499 . . . . 0.0 110.604 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.418 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.54 -49.39 13.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.827 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.517 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.0 mm-40 -72.29 -36.45 68.97 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.798 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.534 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 31.7 pttt -60.67 -34.99 75.13 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.077 0.465 . . . . 0.0 109.882 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -90.1 -35.61 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.69 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -75.54 -35.46 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.741 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.517 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 83.4 t -79.46 -39.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.311 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.707 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -60.81 -34.33 74.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.753 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -87.95 -19.11 27.7 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -19.8 13.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 76.9 m -106.34 -27.15 11.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.32 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.3 21.87 4.3 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 120.124 -1.036 . . . . 0.0 114.037 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.707 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -110.27 -164.77 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.05 0.425 . . . . 0.0 110.166 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.408 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -148.8 156.98 41.24 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.676 0.275 . . . . 0.0 110.931 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -49.67 -26.87 13.79 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.62 2.213 . . . . 0.0 112.496 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.488 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.4 tp -88.91 -29.01 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 0.0 110.562 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.497 ' HA ' HG23 ' A' ' 47' ' ' VAL . 35.8 mm-40 -80.57 -58.23 3.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.77 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.513 ' O ' ' HB2' ' A' ' 49' ' ' PHE . 22.7 m -35.73 -35.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.508 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.509 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -79.7 -55.39 5.04 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.667 179.526 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.497 HG23 ' HA ' ' A' ' 44' ' ' GLN . 29.7 m -69.84 -44.27 79.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.457 0.646 . . . . 0.0 111.202 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.472 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -62.43 -51.49 67.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.211 -179.459 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.513 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 22.5 m-30 -67.57 -25.73 65.94 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.525 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -56.96 -50.58 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.953 0.406 . . . . 0.0 110.375 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -80.42 -32.23 37.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.523 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -92.95 16.1 13.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.027 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -178.15 35.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.11 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.89 79.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.407 . . . . 0.0 110.654 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.5 mmm180 -80.07 -62.02 1.81 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.815 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.55 -167.96 2.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.86 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.965 179.9 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 6.1 tptm . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.911 0.386 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -163.14 -66.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.949 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -96.48 102.89 14.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.938 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.5 -33.2 74.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.839 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.9 m -77.53 117.92 68.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.844 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.34 -74.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.338 2.025 . . . . 0.0 112.336 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt 57.17 37.63 28.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.934 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -139.59 -161.35 8.69 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.455 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -153.29 124.48 7.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.873 0.368 . . . . 0.0 110.831 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.89 113.68 14.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.918 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -160.53 146.27 14.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.91 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.409 HG21 ' CB ' ' A' ' 12' ' ' ALA . 12.9 tt -176.76 166.9 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.908 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.667 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -50.95 -176.61 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.414 179.282 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.667 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -52.09 -23.69 17.93 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.81 1.674 . . . . 0.0 110.952 179.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -52.12 -24.94 7.73 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.661 179.012 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.409 ' CB ' HG21 ' A' ' 8' ' ' ILE . . . -43.99 -59.22 2.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.265 0.555 . . . . 0.0 110.081 179.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -82.07 -34.97 29.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.668 178.858 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.71 -53.91 43.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.011 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.561 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -57.0 -46.97 81.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.34 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.53 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -69.86 -30.03 67.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.264 179.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.511 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.9 mt-10 -54.88 -62.8 1.42 Allowed 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.533 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -60.76 -30.97 70.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.986 178.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.501 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 54.4 t -61.76 -61.88 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.423 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 34.4 t80 -65.6 -14.86 62.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.638 178.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.27 -40.13 52.53 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.97 0.414 . . . . 0.0 110.493 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.7 mtp180 -59.12 -42.96 91.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.719 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -161.48 -145.61 0.11 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.55 179.372 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.48 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.12 -50.54 0.43 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.026 0.441 . . . . 0.0 111.589 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -95.29 81.27 3.6 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.48 ' CD2' ' CG ' ' A' ' 23' ' ' LYS . 4.4 mt -74.5 135.61 42.21 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.9 -178.64 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.407 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 1.3 m -51.13 -27.4 8.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.194 0.521 . . . . 0.0 110.439 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.79 -50.36 11.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.871 179.852 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' A' ' 34' ' ' VAL . 5.3 mt-10 -71.02 -37.99 72.6 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.046 0.45 . . . . 0.0 109.795 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 3.7 pttp -60.5 -34.84 74.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.954 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.53 -35.95 15.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.625 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -75.28 -35.74 61.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.575 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 30' ' ' GLU . 85.6 t -78.67 -37.47 20.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.102 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.681 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -65.47 -30.83 71.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.037 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -87.48 -19.89 27.33 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.404 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.1 OUTLIER -105.37 -23.31 12.87 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.499 -179.398 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 64.3 m -98.68 -28.27 13.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.37 21.76 5.06 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.363 -0.922 . . . . 0.0 113.454 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.681 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.14 -163.37 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.92 157.66 35.41 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.693 0.282 . . . . 0.0 111.104 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.404 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 77.1 Cg_exo -50.27 -25.01 12.63 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.498 2.132 . . . . 0.0 112.249 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.504 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -89.33 -30.28 18.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.588 179.607 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.537 ' HA ' HG23 ' A' ' 47' ' ' VAL . 32.8 mm-40 -80.47 -58.27 3.2 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.856 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.54 ' O ' ' CD2' ' A' ' 49' ' ' PHE . 21.0 m -34.69 -41.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.841 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -71.56 -60.48 2.21 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.719 179.063 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.537 HG23 ' HA ' ' A' ' 44' ' ' GLN . 15.3 m -63.38 -44.13 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 121.264 0.554 . . . . 0.0 111.259 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.472 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -61.99 -53.64 52.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.957 -179.38 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.54 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 22.7 m-85 -68.59 -18.72 64.38 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 120.667 0.27 . . . . 0.0 110.858 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -62.39 -55.75 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.846 0.355 . . . . 0.0 110.379 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -78.14 -34.07 50.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.217 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.414 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 49.1 mmtt -77.84 -31.88 51.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.133 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.477 ' O ' ' N ' ' A' ' 55' ' ' ARG . 8.1 ttp180 -125.36 31.89 5.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.424 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.5 OUTLIER -49.49 89.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 179.885 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -74.48 -43.32 56.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.79 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -61.96 -44.44 96.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.847 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.915 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.816 0.341 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -121.86 119.98 33.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.21 59.35 0.97 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.83 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -65.43 -64.07 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.785 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.3 p -158.88 143.58 11.57 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.785 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.56 -169.51 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.455 2.103 . . . . 0.0 112.333 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -128.39 87.91 2.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.852 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.88 -53.93 0.73 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.263 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.5 mttt 63.03 -80.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.793 0.33 . . . . 0.0 111.138 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 62.01 -179.71 0.13 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.848 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.3 m -84.24 179.93 7.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.908 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.401 HG22 ' CB ' ' A' ' 12' ' ' ALA . 5.8 tt -113.24 167.76 6.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.005 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.664 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.14 -175.78 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.007 179.163 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.664 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -53.46 -22.3 20.98 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 121.62 1.547 . . . . 0.0 110.961 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.516 ' O ' ' N ' ' A' ' 15' ' ' PHE . 27.3 mt-30 -50.09 -26.32 4.34 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.807 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.401 ' CB ' HG22 ' A' ' 8' ' ' ILE . . . -41.94 -58.38 2.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.286 0.565 . . . . 0.0 110.125 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.416 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -81.81 -37.67 26.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.779 178.79 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.32 -56.08 24.5 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.831 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.598 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -53.1 -48.86 67.47 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.675 179.143 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.542 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -67.22 -30.06 69.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.201 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -55.78 -65.37 0.61 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.57 179.064 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -59.35 -28.86 67.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.371 178.909 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.51 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 42.0 t -62.38 -60.26 3.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.342 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.415 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 26.9 t80 -68.94 -13.02 62.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -83.69 -35.01 24.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.903 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 46.2 mtp85 -59.46 -39.52 83.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.176 0.512 . . . . 0.0 110.313 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.495 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -158.62 -145.5 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.394 179.177 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.465 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.72 -50.6 0.41 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.078 0.466 . . . . 0.0 111.59 -179.032 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.2 t -95.63 81.25 3.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.724 -178.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.495 ' CD2' ' CG ' ' A' ' 23' ' ' LYS . 3.7 mt -73.42 117.13 14.8 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -93.45 175.69 6.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.647 0.261 . . . . 0.0 110.871 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.5 m -44.66 -29.85 0.82 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.997 0.427 . . . . 0.0 111.131 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.7 mmpt? -78.01 -48.6 15.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.763 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.512 ' O ' ' N ' ' A' ' 34' ' ' VAL . 3.3 mt-10 -71.14 -37.96 72.26 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.979 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.563 ' O ' ' HB1' ' A' ' 35' ' ' ALA . 13.3 pttt -60.74 -34.14 73.98 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.65 -36.58 15.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.406 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.8 mm-40 -74.5 -35.82 63.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.487 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.512 ' N ' ' O ' ' A' ' 30' ' ' GLU . 75.3 t -78.33 -37.82 22.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.017 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.68 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -65.15 -31.16 72.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.059 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ptmt -87.47 -19.76 27.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.434 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.45 -23.55 12.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.585 0.231 . . . . 0.0 111.571 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 61.0 m -99.78 -25.56 14.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.482 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.23 26.9 4.13 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.304 -0.95 . . . . 0.0 113.582 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.68 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -115.48 -164.22 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.067 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.403 ' CG2' ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.38 159.15 35.39 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.31 . . . . 0.0 111.135 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.403 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 65.9 Cg_exo -51.27 -24.45 15.56 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.527 2.151 . . . . 0.0 112.304 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -89.73 -31.28 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.181 179.666 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 48' ' ' TRP . 26.8 mm-40 -79.63 -58.15 3.33 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.802 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.55 ' O ' ' CD2' ' A' ' 49' ' ' PHE . 23.9 m -35.14 -43.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.019 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -70.29 -59.61 2.77 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.922 179.362 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.486 HG22 ' HA ' ' A' ' 44' ' ' GLN . 19.0 m -65.21 -45.22 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 121.235 0.54 . . . . 0.0 111.522 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.502 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -60.87 -52.74 63.76 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.001 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.55 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 22.4 m-85 -67.85 -25.39 65.52 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.628 0.252 . . . . 0.0 110.805 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -56.46 -53.92 34.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -79.84 -29.2 40.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.685 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.447 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 15.0 mmtt -93.0 12.64 23.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.173 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 11.6 ttp180 -174.35 34.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ttm -55.81 85.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 110.912 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.3 mmp_? -64.71 -44.45 90.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.862 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.13 -50.89 0.65 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.9 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.829 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.787 0.327 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.24 19.69 13.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.183 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 53.36 88.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.839 0.352 . . . . 0.0 111.057 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 7.5 mtmp? -91.41 136.39 33.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.9 t -136.73 65.21 53.29 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.987 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.97 113.6 1.48 Allowed 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.574 2.183 . . . . 0.0 112.192 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.59 -74.22 0.5 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.891 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.87 174.23 35.92 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.612 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.7 mmtm 62.16 63.85 1.03 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.836 0.35 . . . . 0.0 110.737 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 t 57.76 45.8 18.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.659 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -26.83 46.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.257 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 2.6 tt -97.43 168.19 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.013 0.435 . . . . 0.0 111.282 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.669 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -63.09 -174.98 0.11 Allowed Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.508 179.342 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.669 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.2 Cg_endo -50.57 -22.47 9.26 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.553 1.502 . . . . 0.0 111.076 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' PHE . 29.0 mt-30 -47.79 -25.62 1.33 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.948 179.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.41 -55.87 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 109.987 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.11 -35.73 31.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.974 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 17' ' ' GLU . . . -66.46 -54.46 23.84 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.248 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.526 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -53.32 -49.25 67.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.977 179.532 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.504 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -71.15 -33.88 70.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.914 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.677 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.3 mm-40 -49.72 -54.82 16.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.172 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -70.21 -33.86 72.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.402 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.466 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 97.9 t -59.63 -65.42 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -60.75 -18.68 56.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.775 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.677 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.5 OUTLIER -72.61 -41.8 65.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.43 . . . . 0.0 110.358 179.654 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -61.26 -41.33 96.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.506 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.487 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -169.07 -156.78 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.24 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -134.56 -51.01 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.99 0.424 . . . . 0.0 111.607 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.6 t -84.12 78.54 9.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.52 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.487 ' CD2' ' HG3' ' A' ' 23' ' ' LYS . 1.8 mt -76.04 134.25 40.14 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.415 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -98.27 178.78 4.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.673 0.273 . . . . 0.0 110.416 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.4 m -51.23 -27.11 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.215 0.531 . . . . 0.0 110.405 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.11 -51.27 10.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.839 179.87 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.506 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.3 mt-10 -70.53 -39.1 74.24 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.834 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.561 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 9.5 pttt -59.19 -35.24 73.23 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.72 -37.97 14.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.494 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 11.0 mm-40 -72.9 -35.09 67.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.764 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 85.0 t -79.81 -39.11 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.317 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.671 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -63.96 -29.85 70.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.125 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -87.31 -21.91 25.45 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.435 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 9.8 ptmt -102.72 -30.45 10.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.73 0.3 . . . . 0.0 111.396 -179.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 75.7 m -90.42 -29.9 17.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.047 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.33 21.5 5.16 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.355 -0.926 . . . . 0.0 113.408 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.671 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -106.5 -161.96 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.43 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -152.31 155.35 33.03 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 111.119 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.407 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 71.0 Cg_exo -48.86 -25.91 9.14 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.572 2.181 . . . . 0.0 112.306 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 4.9 tp -87.86 -28.97 21.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.593 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.53 ' O ' ' N ' ' A' ' 48' ' ' TRP . 35.8 mm-40 -82.44 -58.53 2.89 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.984 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.515 HG11 ' HB3' ' A' ' 35' ' ' ALA . 24.6 m -35.9 -34.09 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.202 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.517 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.2 -58.8 2.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.078 179.482 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.475 HG22 ' HA ' ' A' ' 44' ' ' GLN . 20.0 m -70.11 -44.57 78.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.276 0.56 . . . . 0.0 111.448 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.53 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -60.33 -55.68 30.7 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.655 -179.595 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.51 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 19.8 m-30 -61.44 -26.9 68.18 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.488 178.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.517 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.9 mm -59.62 -51.83 68.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.329 . . . . 0.0 110.485 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -80.59 -39.39 27.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.215 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.492 ' HG2' ' CZ3' ' A' ' 48' ' ' TRP . 0.7 OUTLIER -75.2 -21.94 58.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.225 -179.785 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 7.2 ttm180 -134.96 30.21 3.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.564 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.415 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.8 ttp -48.39 91.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.88 0.371 . . . . 0.0 111.033 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -73.74 -41.87 61.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.936 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.5 t 38.54 55.03 1.89 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.927 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.18 -0.914 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.846 0.355 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -138.6 140.89 39.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.987 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 59.1 109.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.981 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.92 127.23 30.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.017 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.88 165.53 5.87 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.853 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.54 149.59 84.27 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.565 2.177 . . . . 0.0 112.28 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -126.85 152.67 46.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.844 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.47 144.28 16.13 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.445 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 163.28 3.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.872 0.368 . . . . 0.0 110.866 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 m 70.26 -63.4 0.4 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.076 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 71.95 -65.03 0.37 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.822 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.4 tt -154.61 169.08 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.212 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.66 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -56.35 -176.93 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.826 179.102 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.66 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.3 Cg_endo -51.06 -23.97 13.47 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 121.638 1.558 . . . . 0.0 110.895 179.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.559 ' O ' ' N ' ' A' ' 15' ' ' PHE . 29.5 mt-30 -47.96 -27.27 2.11 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.858 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.415 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -42.92 -57.8 2.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.23 0.538 . . . . 0.0 110.04 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.446 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.86 -34.15 30.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.768 178.886 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.41 -57.5 7.27 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.559 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -53.13 -47.99 68.26 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.168 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.513 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -67.61 -39.46 84.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.812 178.675 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.637 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.7 mm-40 -45.88 -61.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.338 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -64.61 -34.22 77.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.386 179.169 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.517 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 54.9 t -57.77 -65.9 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.108 0.48 . . . . 0.0 109.896 178.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.444 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 41.3 t80 -62.26 -15.0 44.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.711 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.637 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -81.07 -36.92 29.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.921 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.48 -37.24 77.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.074 0.464 . . . . 0.0 110.501 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.506 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -167.8 -143.95 0.05 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.494 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.506 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 29.3 mm-40 -145.82 -48.75 0.22 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.007 0.432 . . . . 0.0 111.59 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 t -83.24 71.08 10.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.342 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.479 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 2.7 mt -74.1 110.65 8.56 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.04 179.8 5.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.189 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.9 m -44.92 -30.61 1.04 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.737 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.1 mmpt? -78.25 -48.86 14.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.932 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.512 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.6 mt-10 -71.4 -37.92 71.48 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.816 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.539 ' HB2' ' CG2' ' A' ' 45' ' ' VAL . 32.3 pttt -59.66 -34.97 73.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.049 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -90.18 -37.21 14.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.574 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.1 mm-40 -73.57 -35.3 65.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.639 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.512 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 75.8 t -79.01 -40.71 22.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.36 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.65 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -61.05 -31.25 70.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.006 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -87.63 -19.45 27.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -105.5 -23.42 12.81 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.543 -179.403 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 60.8 m -99.42 -28.39 13.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.274 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.55 20.39 5.45 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.709 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.65 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -106.61 -167.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 178.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.409 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -144.19 155.53 58.15 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.293 . . . . 0.0 111.119 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.403 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 75.6 Cg_exo -49.41 -25.92 11.1 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.702 2.268 . . . . 0.0 112.524 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.495 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -89.01 -27.1 21.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.08 0.467 . . . . 0.0 110.784 179.78 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.539 ' O ' ' N ' ' A' ' 48' ' ' TRP . 38.6 mm-40 -81.89 -58.96 2.75 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.817 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.545 HG12 ' HB2' ' A' ' 35' ' ' ALA . 25.6 m -36.7 -34.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.186 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.701 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -78.71 -62.75 1.59 Allowed 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.031 179.577 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.455 ' CG2' ' N ' ' A' ' 48' ' ' TRP . 11.1 m -70.27 -46.9 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 111.67 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.539 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -56.57 -48.41 77.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.612 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.536 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 15.9 m-30 -65.62 -31.86 73.13 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.905 179.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.701 HG12 ' O ' ' A' ' 46' ' ' ARG . 2.7 mm -49.75 -52.34 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.97 0.414 . . . . 0.0 110.566 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.37 -33.67 48.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.145 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.45 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 22.9 mmtt -95.54 22.87 6.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.168 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 55' ' ' ARG . 5.3 ttp180 -178.9 29.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.315 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -52.29 84.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.526 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.9 mmp_? -71.4 -49.41 42.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.078 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -136.03 173.93 11.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.4 mttp . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.868 179.986 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.765 0.317 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 60.05 -174.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.882 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -83.5 127.72 33.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.867 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.47 120.44 3.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.418 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.4 OUTLIER -74.37 -52.29 4.05 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.982 -179.974 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 1' ' ' SER . 52.4 Cg_exo -54.76 147.81 48.6 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.445 2.097 . . . . 0.0 112.199 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.8 -36.64 31.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.872 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.22 -22.98 3.36 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.749 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.2 tttt 59.88 65.92 1.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.904 0.383 . . . . 0.0 110.683 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 72.4 p -58.1 -38.85 77.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.054 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.3 t -84.62 70.11 10.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.869 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.41 HG22 ' CB ' ' A' ' 12' ' ' ALA . 6.0 tt -87.86 166.58 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.068 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.658 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.01 -176.51 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.01 179.14 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.658 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 12.4 Cg_endo -54.52 -20.85 22.16 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 121.658 1.572 . . . . 0.0 110.945 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.545 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -53.18 -23.22 7.87 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.891 179.253 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.417 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -46.06 -58.28 3.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.274 0.559 . . . . 0.0 110.114 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.78 -35.65 32.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.702 179.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.51 -51.12 62.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.405 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.589 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -56.5 -48.06 77.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.372 179.936 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.579 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -75.39 -27.34 59.05 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.177 179.344 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.1 mt-10 -54.25 -59.46 4.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -62.65 -32.16 73.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.989 178.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.443 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 55.8 t -60.27 -59.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.411 179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.428 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 18.5 t80 -68.52 -14.01 62.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.901 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.64 -36.17 26.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.857 0.36 . . . . 0.0 110.558 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -60.84 -37.92 83.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.57 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.491 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 1.1 ptmm? -164.44 -147.91 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.372 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.491 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 27.6 mm-40 -146.34 -48.53 0.2 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.903 0.382 . . . . 0.0 111.675 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.3 t -83.18 73.64 10.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.448 ' CD2' ' CG ' ' A' ' 23' ' ' LYS . 1.0 OUTLIER -74.65 117.0 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -94.99 177.09 6.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.875 0.369 . . . . 0.0 110.934 -179.641 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.4 m -47.93 -29.14 3.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.161 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 3.4 mmpt? -78.23 -48.55 15.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.793 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.523 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.2 mt-10 -71.75 -36.83 70.55 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.946 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.543 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 16.1 pttt -61.54 -34.55 75.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.001 0.429 . . . . 0.0 110.057 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -89.83 -36.44 15.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.505 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 7.3 mm-40 -74.72 -35.53 62.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.683 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 79.6 t -79.16 -38.92 20.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.245 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.683 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -63.1 -31.68 72.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.95 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -87.71 -20.21 26.55 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.462 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 1.4 pttp -105.35 -24.19 12.71 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.529 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 77.0 m -98.15 -27.77 14.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.228 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.77 23.85 4.19 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.16 -1.019 . . . . 0.0 113.702 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.683 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -112.01 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.953 0.376 . . . . 0.0 110.117 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.67 157.11 44.8 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.775 0.321 . . . . 0.0 111.003 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -51.19 -23.99 14.2 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.58 2.187 . . . . 0.0 112.3 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.506 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -91.38 -28.3 17.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.1 0.476 . . . . 0.0 110.757 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.531 ' O ' ' N ' ' A' ' 48' ' ' TRP . 28.5 mm-40 -80.97 -57.0 3.73 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.56 ' O ' ' CD2' ' A' ' 49' ' ' PHE . 18.6 m -36.23 -36.4 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.117 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -78.14 -57.57 3.72 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.834 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.492 HG23 ' HA ' ' A' ' 44' ' ' GLN . 21.0 m -68.27 -44.87 83.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.214 0.531 . . . . 0.0 111.451 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.531 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -61.05 -53.2 60.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.958 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.56 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 23.0 m-30 -66.46 -28.9 68.95 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.672 0.272 . . . . 0.0 110.521 179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -54.93 -52.74 40.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.861 0.362 . . . . 0.0 110.562 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -78.01 -29.07 49.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.159 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.461 ' HG3' ' CE3' ' A' ' 48' ' ' TRP . 35.5 mmtt -94.87 19.0 10.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.791 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 55' ' ' ARG . 11.1 ttp-105 -178.34 33.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.061 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 ttm -58.71 76.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.01 0.433 . . . . 0.0 110.72 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 53' ' ' ARG . 28.4 mmm-85 -62.26 -38.57 89.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.117 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.32 -55.44 1.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.322 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.153 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 3.3 pttp . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 120.758 0.313 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 14.2 mmmt -108.08 -28.38 9.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.026 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -139.72 149.22 43.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.882 0.372 . . . . 0.0 111.015 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -82.84 168.32 17.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.727 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 2' ' ' PRO . 0.4 OUTLIER -66.23 -51.73 42.63 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.884 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.435 ' HD3' ' CB ' ' A' ' 1' ' ' SER . 9.9 Cg_exo -71.75 60.4 2.86 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.747 2.298 . . . . 0.0 112.192 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 16.7 mttt 67.37 -70.37 0.12 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.061 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.63 94.37 0.1 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.523 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -159.97 -49.7 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.798 0.332 . . . . 0.0 110.743 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 t 60.87 111.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.979 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.6 t -69.72 135.33 49.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.734 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.6 tt -98.55 165.39 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.99 0.424 . . . . 0.0 111.386 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.685 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.99 -175.58 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.137 179.329 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.685 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.3 Cg_endo -50.85 -23.93 12.61 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.904 1.736 . . . . 0.0 110.949 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.437 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.8 OUTLIER -50.34 -22.77 1.96 Allowed 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.083 179.047 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -48.12 -56.88 6.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.298 0.571 . . . . 0.0 109.747 178.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.425 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -81.22 -34.41 32.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.712 179.039 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.421 ' HA ' ' HB2' ' A' ' 17' ' ' GLU . . . -66.54 -48.41 69.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.411 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -58.81 -45.1 90.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.889 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.549 HD21 ' HG3' ' A' ' 52' ' ' LYS . 24.1 tp -76.13 -30.78 58.33 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.926 178.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.547 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 2.5 mt-10 -52.23 -43.45 64.31 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.83 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -81.77 -28.21 33.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.584 179.242 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.438 HG12 ' CZ ' ' A' ' 49' ' ' PHE . 86.6 t -67.2 -64.02 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.876 0.37 . . . . 0.0 110.388 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.447 ' CE2' ' HG3' ' A' ' 53' ' ' ARG . 11.0 t80 -60.4 -26.47 66.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.772 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.547 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -77.43 -42.63 35.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.498 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.6 mtp85 -59.74 -40.13 87.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.499 . . . . 0.0 110.194 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.456 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.22 -160.35 0.54 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.519 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 41.0 mm-40 -141.99 -46.63 0.35 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.207 0.527 . . . . 0.0 111.526 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.9 t -74.99 71.38 2.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.158 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.468 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -76.78 109.51 10.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.958 178.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 -179.15 4.65 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.6 t -50.74 -28.43 9.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.187 0.517 . . . . 0.0 110.347 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.445 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.01 -50.91 11.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.958 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.505 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.0 mm-40 -70.89 -38.41 73.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.032 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.561 ' HB2' ' CG2' ' A' ' 45' ' ' VAL . 6.4 pttp -60.23 -34.68 74.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.025 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.81 -37.19 13.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.584 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.5 mm-40 -73.8 -37.34 64.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.872 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.505 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 93.3 t -78.18 -40.0 25.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.299 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.622 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -60.95 -31.74 71.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.443 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -88.06 -19.9 26.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.34 -25.73 13.19 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.646 -179.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.9 m -98.27 -28.71 13.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.139 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.73 20.69 4.89 Favored Glycine 0 C--N 1.33 0.21 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.504 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.622 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.1 OUTLIER -105.77 -163.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.413 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -148.49 157.2 42.01 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.692 0.282 . . . . 0.0 111.074 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.423 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 63.2 Cg_exo -51.52 -23.8 15.43 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.599 2.199 . . . . 0.0 112.281 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -90.7 -27.23 19.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.056 0.455 . . . . 0.0 110.694 179.693 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 48' ' ' TRP . 35.7 mm-40 -81.5 -59.5 2.6 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.829 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.581 HG12 ' HB3' ' A' ' 35' ' ' ALA . 20.5 m -35.82 -32.96 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.445 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.488 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.77 -59.94 2.42 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.6 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.448 HG22 ' HA ' ' A' ' 44' ' ' GLN . 19.9 m -67.95 -43.86 85.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.359 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.499 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -62.0 -54.08 46.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.042 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.507 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 21.6 m-30 -65.88 -24.61 66.89 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.704 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -55.49 -58.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.677 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -79.17 -32.4 44.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.051 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.549 ' HG3' HD21 ' A' ' 16' ' ' LEU . 13.6 mmtt -85.15 1.02 49.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.539 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -164.93 37.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.971 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.3 ttp -62.25 73.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.976 0.417 . . . . 0.0 110.822 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' A' ' 53' ' ' ARG . 44.7 mmm-85 -68.55 -43.18 77.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.778 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.5 t -55.81 132.67 49.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.03 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.866 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 9.8 mmmt . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.814 0.34 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -39.94 87.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.892 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -175.8 -69.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.94 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 2.9 mtpm? -98.89 175.63 5.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.941 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.4 t 60.37 63.66 2.83 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.903 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.4 -35.22 53.78 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.56 2.173 . . . . 0.0 112.4 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -149.47 166.42 29.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.002 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.02 166.27 29.75 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.458 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.4 ' O ' ' N ' ' A' ' 7' ' ' SER . 7.8 mmtt 60.82 84.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.8 0.333 . . . . 0.0 110.799 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.53 -82.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.989 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 5' ' ' LYS . 0.4 OUTLIER 171.14 -70.91 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.827 0.346 . . . . 0.0 110.901 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.5 tt -93.24 169.39 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.064 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.652 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.92 -175.67 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.02 179.293 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.652 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.55 -24.25 12.24 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.607 1.538 . . . . 0.0 111.087 179.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.559 ' O ' ' N ' ' A' ' 15' ' ' PHE . 28.8 mt-30 -48.83 -26.85 2.63 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.579 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.95 -55.05 5.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.219 0.533 . . . . 0.0 110.025 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -81.54 -36.34 29.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.678 178.956 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.51 -57.44 7.31 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.515 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.559 ' N ' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -53.73 -49.09 68.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.93 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.447 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 2.2 tp -68.91 -34.15 74.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.098 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.664 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -49.97 -59.53 3.79 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.159 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.31 -37.1 84.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.758 179.476 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.476 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 93.0 t -56.12 -68.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.831 0.348 . . . . 0.0 110.085 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -16.29 15.92 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.989 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.664 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -80.0 -37.96 33.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.745 0.307 . . . . 0.0 111.223 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 -59.06 -37.33 76.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.468 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.2 ptmt -167.15 -145.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.537 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.445 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -140.68 -50.25 0.45 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.928 0.395 . . . . 0.0 111.716 -179.131 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.6 78.57 4.31 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.494 ' CD1' ' CE2' ' A' ' 49' ' ' PHE . 5.1 mt -72.3 124.71 25.65 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.01 176.89 5.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.756 0.312 . . . . 0.0 111.145 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.412 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 12.0 t -44.69 -31.17 1.09 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.8 mmpt? -78.66 -47.22 17.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.914 0.388 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.2 mt-10 -70.69 -38.34 73.68 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.81 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.559 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 7.1 pttt -59.95 -34.98 73.99 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -89.72 -37.38 14.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.545 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -73.05 -35.73 66.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.555 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.516 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 80.1 t -79.48 -38.16 19.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.252 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.614 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -64.6 -31.87 73.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.441 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -87.82 -19.6 27.24 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -26.2 13.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.661 0.267 . . . . 0.0 111.566 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 86.2 m -97.6 -28.44 13.94 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.299 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.42 23.33 4.48 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.35 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.614 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.8 -163.89 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.086 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.436 ' CG2' ' HD2' ' A' ' 42' ' ' PRO . 0.0 OUTLIER -149.18 153.02 37.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.591 0.234 . . . . 0.0 110.809 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.436 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 5.0 Cg_endo -47.38 -26.97 6.47 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.827 2.351 . . . . 0.0 112.239 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.462 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.6 OUTLIER -84.1 -30.33 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.588 179.641 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.509 ' O ' ' N ' ' A' ' 48' ' ' TRP . 25.9 mm-40 -81.77 -57.55 3.39 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.779 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.527 HG13 ' HB1' ' A' ' 35' ' ' ALA . 22.8 m -36.69 -32.75 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.422 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.509 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -83.32 -56.5 3.73 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.886 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.501 HG23 ' HA ' ' A' ' 44' ' ' GLN . 28.2 m -69.8 -42.82 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.376 0.608 . . . . 0.0 111.178 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.509 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -63.33 -55.86 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.829 -179.53 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.527 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 20.1 m-30 -64.15 -18.87 64.87 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-O 120.682 0.277 . . . . 0.0 110.588 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -64.45 -55.36 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.893 0.377 . . . . 0.0 110.388 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 -77.72 -34.9 52.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.916 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.442 ' HG3' HD13 ' A' ' 16' ' ' LEU . 15.2 mmtt -81.47 -19.56 42.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.132 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 55' ' ' ARG . 8.9 ttm180 -145.04 44.03 1.33 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.741 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.49 68.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.996 0.427 . . . . 0.0 110.48 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 53' ' ' ARG . 5.9 mmp_? -73.57 -57.81 3.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.962 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t 36.4 -89.34 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.365 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.815 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.911 0.386 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm 60.33 33.92 20.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.957 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -158.92 -72.05 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.967 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm 60.65 104.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.83 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.4 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -178.88 -61.24 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.11 -179.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.4 ' HD2' ' N ' ' A' ' 1' ' ' SER . 46.2 Cg_endo -67.71 -165.69 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.429 2.086 . . . . 0.0 112.295 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 68.53 90.45 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.936 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 73.7 155.8 3.81 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.742 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.57 157.24 47.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.823 0.344 . . . . 0.0 110.875 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.8 p 58.03 46.19 16.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.878 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.1 t -62.93 165.52 6.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.829 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 6.3 tt -62.23 166.68 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.087 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.666 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.42 -176.48 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.105 179.271 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.666 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.7 Cg_endo -50.75 -24.38 13.13 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.936 1.757 . . . . 0.0 111.02 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.52 ' O ' ' N ' ' A' ' 15' ' ' PHE . 1.3 mt-30 -49.98 -26.33 4.15 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.837 179.091 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.442 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -41.7 -59.76 1.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.303 0.573 . . . . 0.0 110.058 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.438 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.32 -33.93 28.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.517 178.674 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.69 -58.19 6.96 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.344 -179.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.563 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -57.73 -45.15 86.19 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.563 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -67.59 -36.17 80.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.022 0.439 . . . . 0.0 109.963 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.8 mt-10 -50.03 -66.4 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.701 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -58.69 -34.78 71.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.485 ' CG2' ' O ' ' A' ' 15' ' ' PHE . 34.4 t -58.31 -59.08 4.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.0 0.428 . . . . 0.0 110.243 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.431 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 5.1 t80 -69.75 -12.92 62.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.144 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -84.82 -37.39 20.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.858 0.361 . . . . 0.0 110.955 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.42 -37.11 84.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.652 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.591 ' HD2' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -160.01 -164.76 1.35 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.546 179.851 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 20' ' ' PHE . 40.8 mm-40 -137.78 -20.88 1.13 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.227 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.8 t -102.89 74.33 1.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.583 HD23 ' HD3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -71.5 97.57 1.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.324 178.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.431 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -88.46 172.17 9.56 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.257 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.9 t -44.53 -31.21 1.04 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.1 mmpt? -78.18 -49.75 13.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.833 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.53 ' O ' ' N ' ' A' ' 34' ' ' VAL . 1.9 mm-40 -68.94 -41.82 77.57 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.913 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 6.9 pttp -57.52 -35.48 70.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.29 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -89.04 -37.57 15.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.58 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.432 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.2 mm-40 -73.48 -35.52 65.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.602 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.53 ' N ' ' O ' ' A' ' 30' ' ' GLU . 81.2 t -79.42 -38.41 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.298 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.663 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -62.45 -35.09 78.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.456 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.12 -19.69 26.66 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.094 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.58 -25.47 13.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 76.5 m -101.64 -28.3 12.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.305 -179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.08 23.85 3.45 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.251 -0.976 . . . . 0.0 114.096 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.663 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -110.8 -163.13 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 178.924 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.427 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -150.92 154.13 34.06 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 0.0 110.945 180.0 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -47.42 -27.12 6.79 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.707 2.271 . . . . 0.0 112.382 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -88.47 -29.96 19.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.501 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 48' ' ' TRP . 33.7 mm-40 -80.38 -58.75 2.98 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.775 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.538 ' O ' ' CD2' ' A' ' 49' ' ' PHE . 26.9 m -34.79 -40.36 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.817 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.544 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -71.54 -61.58 1.72 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.783 179.264 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.457 HG21 ' HA ' ' A' ' 44' ' ' GLN . 16.8 m -64.6 -43.59 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 121.427 0.632 . . . . 0.0 111.386 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.474 ' HB2' ' O ' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -62.88 -51.45 66.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.249 -178.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.538 ' CD2' ' O ' ' A' ' 45' ' ' VAL . 22.1 m-85 -70.2 -19.64 63.16 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.895 179.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.3 mm -59.63 -66.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.28 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -66.58 -39.77 88.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.244 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.435 ' HG3' ' HG ' ' A' ' 16' ' ' LEU . 19.9 mmtt -70.02 -57.08 5.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.11 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.498 ' O ' ' N ' ' A' ' 55' ' ' ARG . 7.7 ttm180 -98.75 32.49 2.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.634 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.405 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.0 ttp -51.87 86.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.964 0.412 . . . . 0.0 110.755 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.7 mmp_? -73.44 -38.32 65.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.062 -179.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -136.51 -168.02 2.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.044 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.9 mptt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.89 179.962 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.831 0.348 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 5.1 tttp 58.27 84.07 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.906 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -131.47 -60.78 0.93 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.85 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -127.34 -41.15 1.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.066 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.93 153.31 0.14 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.923 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.38 64.73 2.84 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.525 2.15 . . . . 0.0 112.437 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -112.14 -36.0 5.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.76 -79.44 1.16 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.386 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.84 73.74 0.47 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.848 0.356 . . . . 0.0 110.948 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.1 m -72.43 -56.16 5.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.887 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 m -160.84 139.12 9.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.63 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.9 tt -108.46 163.89 5.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.024 0.44 . . . . 0.0 111.404 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.677 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.2 OUTLIER -55.65 -174.08 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.917 179.191 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.677 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.6 Cg_endo -53.22 -21.81 18.13 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.538 1.492 . . . . 0.0 110.971 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.551 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -50.97 -22.32 2.21 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.012 179.16 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.442 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -45.3 -58.07 3.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.25 0.547 . . . . 0.0 109.975 179.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.16 -36.72 29.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.726 178.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.88 -50.48 68.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.178 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.615 ' CD1' ' N ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -56.46 -48.23 77.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.395 179.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.615 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -75.22 -26.37 58.88 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.277 179.474 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.528 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -55.84 -58.92 5.83 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.49 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -63.4 -32.04 73.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.984 178.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.452 HG12 ' CZ ' ' A' ' 49' ' ' PHE . 44.4 t -57.97 -59.05 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.117 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.414 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 10.6 t80 -69.92 -12.79 61.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.409 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.528 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -83.7 -35.45 24.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.477 179.716 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -60.87 -38.56 86.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.213 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 9.6 ptmt -165.05 -149.3 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.399 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.5 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 32.8 mm-40 -144.25 -49.07 0.28 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.057 0.456 . . . . 0.0 111.749 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.6 t -77.75 68.72 3.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.651 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.432 ' CD2' ' CG ' ' A' ' 23' ' ' LYS . 1.7 mt -75.51 109.33 8.97 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.92 176.76 6.22 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.933 0.397 . . . . 0.0 111.235 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.446 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.3 m -45.48 -29.46 1.14 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.502 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.423 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 4.1 mmpt? -79.64 -45.32 19.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.039 0.447 . . . . 0.0 110.558 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.52 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.4 mt-10 -72.41 -35.93 68.5 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.717 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.531 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 24.1 pttt -62.02 -34.88 77.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.944 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -89.24 -36.35 15.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.403 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.423 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -74.65 -36.46 62.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.789 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.52 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 74.9 t -78.83 -38.09 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.359 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.653 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -62.4 -32.03 72.8 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.67 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -88.05 -20.66 25.46 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -25.93 13.08 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 73.2 m -98.7 -27.48 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.63 26.32 3.41 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.03 -1.081 . . . . 0.0 113.671 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.653 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -114.02 -163.65 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.932 0.366 . . . . 0.0 110.092 179.043 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.402 ' CB ' ' HG2' ' A' ' 44' ' ' GLN . 0.2 OUTLIER -149.91 156.9 38.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.3 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -49.91 -24.87 11.12 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.647 2.231 . . . . 0.0 112.338 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.1 tp -89.61 -29.4 18.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.571 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.53 ' O ' ' N ' ' A' ' 48' ' ' TRP . 36.7 mm-40 -80.48 -58.62 3.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.807 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.534 HG11 ' HB1' ' A' ' 35' ' ' ALA . 26.4 m -36.35 -31.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.618 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.53 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.76 -50.68 7.38 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.041 179.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.499 HG21 ' HA ' ' A' ' 44' ' ' GLN . 25.5 m -75.58 -43.08 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.463 0.649 . . . . 0.0 110.732 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.53 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -63.21 -51.26 67.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.821 -179.618 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.518 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 22.2 m-30 -69.11 -18.04 63.92 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.549 0.214 . . . . 0.0 110.943 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -64.04 -59.33 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.535 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -75.28 -28.64 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.326 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.443 ' HG3' HD22 ' A' ' 16' ' ' LEU . 11.5 mmtp -84.57 -32.64 23.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.343 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -128.53 38.21 4.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.207 -179.608 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 ttm -55.84 85.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.85 0.357 . . . . 0.0 110.831 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.1 mmp_? -86.09 -51.46 6.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.958 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -54.08 105.07 0.12 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.135 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.9 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.82 0.343 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -78.87 124.86 28.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.917 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 43.21 94.1 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.473 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -28.8 28.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.359 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.444 ' CB ' ' HD3' ' A' ' 2' ' ' PRO . 0.3 OUTLIER -52.73 -53.6 52.52 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.094 -179.703 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.444 ' HD3' ' CB ' ' A' ' 1' ' ' SER . 23.4 Cg_exo -64.26 -25.64 64.59 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.505 2.137 . . . . 0.0 112.073 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.75 79.73 0.25 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.771 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 128.65 -113.62 1.62 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.438 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.41 68.3 0.09 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.17 -169.39 2.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.953 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 m 61.94 115.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.852 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.406 HG22 ' CB ' ' A' ' 12' ' ' ALA . 8.6 tt -137.01 167.57 23.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.083 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.671 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -52.86 -175.46 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.211 179.325 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.671 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.7 Cg_endo -53.75 -22.42 23.1 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.581 1.521 . . . . 0.0 110.995 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.556 ' O ' ' N ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -51.92 -23.69 5.31 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.851 179.162 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -45.7 -57.66 4.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.29 0.567 . . . . 0.0 110.087 179.108 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.82 -36.07 32.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.592 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.66 -53.55 39.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.525 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.58 ' CE1' HG12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -55.5 -46.92 76.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.581 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.56 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -77.78 -25.18 48.88 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.354 179.558 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.541 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.6 mm-40 -55.64 -56.2 23.15 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.27 -33.96 76.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.947 178.692 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.47 ' HB ' ' HA ' ' A' ' 16' ' ' LEU . 41.9 t -55.18 -59.92 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.059 0.457 . . . . 0.0 109.797 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.497 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 25.1 t80 -71.06 -10.93 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.759 179.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.541 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -78.03 -42.35 32.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.073 0.463 . . . . 0.0 110.476 179.868 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.98 -45.3 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.78 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.463 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -153.15 -155.36 0.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.192 179.682 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.428 ' O ' ' CD ' ' A' ' 53' ' ' ARG . 20.2 mm-40 -140.31 -48.01 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.976 0.417 . . . . 0.0 111.456 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -82.29 78.17 8.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.457 -178.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.463 ' CD2' ' CG ' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -80.11 125.46 29.84 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.592 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.87 -177.93 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.735 0.302 . . . . 0.0 110.551 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 4.3 t -52.79 -26.16 13.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.142 0.496 . . . . 0.0 110.548 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.99 -48.55 14.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.682 179.608 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.9 mm-40 -72.23 -36.51 69.14 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.644 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.54 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 33.7 pttt -60.3 -35.49 75.71 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.023 0.439 . . . . 0.0 109.889 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.592 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.3 -35.82 66.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.871 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.516 ' HB ' ' O ' ' A' ' 30' ' ' GLU . 90.4 t -79.95 -39.48 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.494 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.686 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -61.13 -31.66 71.36 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -87.48 -21.18 25.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.445 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 2.8 pttt -104.63 -26.06 12.48 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.624 -179.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 73.2 m -96.4 -27.49 14.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.258 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.79 21.9 4.85 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.71 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.686 HG13 ' HA ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -109.26 -162.3 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.989 0.394 . . . . 0.0 110.22 179.146 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.401 ' HA ' ' HB2' ' A' ' 35' ' ' ALA . 0.2 OUTLIER -153.57 155.41 31.5 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.624 0.249 . . . . 0.0 110.812 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.4 ' HD2' ' CG2' ' A' ' 41' ' ' THR . 79.0 Cg_exo -48.04 -27.09 8.5 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.593 2.195 . . . . 0.0 112.331 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 17.0 tp -89.06 -27.82 20.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.562 ' HA ' HG21 ' A' ' 47' ' ' VAL . 4.4 mm-40 -82.64 -57.51 3.3 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.782 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.529 HG12 ' HB1' ' A' ' 35' ' ' ALA . 19.1 m -36.12 -33.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.299 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.498 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -82.79 -53.53 5.82 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.901 179.579 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.562 HG21 ' HA ' ' A' ' 44' ' ' GLN . 19.8 m -69.9 -42.71 79.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 121.395 0.617 . . . . 0.0 110.777 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.522 ' CE3' ' CD1' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -64.35 -53.44 48.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.741 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.488 ' HB2' ' O ' ' A' ' 45' ' ' VAL . 19.4 m-30 -67.76 -14.06 62.63 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.753 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.8 OUTLIER -67.38 -56.93 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.854 0.359 . . . . 0.0 110.379 179.817 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -73.26 -30.6 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.047 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.46 ' HG3' ' CD2' ' A' ' 16' ' ' LEU . 2.3 mmtp -82.47 -42.5 18.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.851 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.497 ' HG3' ' CE1' ' A' ' 20' ' ' PHE . 16.9 ttp85 -116.77 38.43 3.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.411 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.418 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -55.01 85.17 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.815 0.34 . . . . 0.0 111.005 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -89.65 -61.97 1.58 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.709 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.4 t -109.09 85.89 2.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.754 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.5 pttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.15 -0.929 . . . . 0.0 111.48 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.646 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.646 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.54 -22.87 13.46 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.565 1.51 . . . . 0.0 110.916 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.75 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 96.6 mt-30 -49.36 -25.16 2.27 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.929 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.24 -56.08 5.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.228 0.537 . . . . 0.0 109.91 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.69 -36.19 28.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.679 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.75 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.73 -55.79 15.49 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.499 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.977 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.3 -52.4 63.56 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.491 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.72 HD11 ' HB3' ' A' ' 52' ' ' LYS . 1.6 tp -63.88 -34.25 77.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.987 178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -52.38 -65.01 0.63 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.316 179.584 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -60.73 -32.27 71.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.833 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.977 HG23 ' O ' ' A' ' 15' ' ' PHE . 89.1 t -59.03 -67.26 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.466 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 28.8 t80 -60.85 -17.53 50.69 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.981 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.564 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.67 -38.22 54.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.88 0.372 . . . . 0.0 110.68 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -59.27 -38.92 81.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.443 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.473 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -170.16 -147.57 0.06 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.804 179.805 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.8 mm-40 -140.41 -51.96 0.48 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.179 0.514 . . . . 0.0 110.983 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.5 t -77.6 70.88 4.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.332 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.975 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.9 mt -74.08 106.38 5.73 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.411 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 4.0 p30 -87.48 178.19 6.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.824 0.345 . . . . 0.0 111.658 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.4 m -48.07 -29.29 3.43 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.445 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.421 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.7 mmpt? -77.63 -47.5 19.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.52 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 22.6 mt-10 -73.03 -35.73 66.81 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.945 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.967 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.1 pttt -61.45 -33.87 74.46 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.029 0.442 . . . . 0.0 109.908 179.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -90.49 -36.49 14.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.421 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.1 mm-40 -74.67 -35.57 62.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.859 HG11 HG13 ' A' ' 19' ' ' VAL . 81.9 t -78.96 -37.88 20.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.3 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.704 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.81 -30.19 71.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.098 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -87.34 -21.06 25.92 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.46 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.6 OUTLIER -103.51 -28.91 11.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.636 0.255 . . . . 0.0 111.428 -179.504 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.706 ' SG ' HG22 ' A' ' 19' ' ' VAL . 78.9 m -92.71 -27.84 17.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.289 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.92 24.29 4.95 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.377 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.888 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.97 -163.91 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.025 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.874 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.27 156.5 37.29 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.761 0.315 . . . . 0.0 111.148 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.874 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.1 Cg_exo -49.65 -24.9 10.27 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.687 2.258 . . . . 0.0 112.292 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.2 OUTLIER -90.0 -27.71 19.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.608 179.775 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.888 ' HB2' HG22 ' A' ' 40' ' ' ILE . 7.8 mm100 -82.57 -58.27 2.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.843 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.967 HG11 ' O ' ' A' ' 31' ' ' LYS . 24.9 m -36.67 -32.61 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.282 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.532 ' O ' HG12 ' A' ' 50' ' ' ILE . 1.1 ptp85 -82.37 -60.57 2.16 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.76 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.543 HG23 ' N ' ' A' ' 48' ' ' TRP . 17.2 m -67.87 -44.58 85.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.329 0.585 . . . . 0.0 111.33 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.579 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.85 -52.83 63.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.797 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.975 ' CE2' HD12 ' A' ' 26' ' ' LEU . 18.2 m-30 -64.85 -28.0 69.26 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.714 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.8 mm -53.89 -51.67 42.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.66 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -80.13 -30.65 39.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.695 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.72 ' HB3' HD11 ' A' ' 16' ' ' LEU . 14.6 mmtt -94.94 18.78 11.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.103 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 49' ' ' PHE . 3.6 ttm105 -179.84 33.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.077 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.4 ttt . . . . . 0 C--N 1.332 -0.191 0 CA-C-O 120.882 0.373 . . . . 0.0 110.851 -179.93 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.662 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.662 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.87 -24.45 13.67 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 121.643 1.562 . . . . 0.0 110.964 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.759 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 98.1 mt-30 -47.63 -27.36 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.699 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.38 -55.85 3.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.184 0.516 . . . . 0.0 110.038 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.66 -36.44 28.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.759 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.06 -56.01 15.52 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.643 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.956 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -56.11 -50.71 70.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.562 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.657 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.1 tp -65.5 -31.71 72.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.918 178.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.478 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 4.0 mt-10 -56.33 -56.15 24.68 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.393 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.466 ' HA ' ' HD3' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -70.48 -24.39 62.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.997 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.956 HG23 ' O ' ' A' ' 15' ' ' PHE . 89.5 t -73.08 -64.22 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.01 0.433 . . . . 0.0 110.951 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.582 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 21.4 t80 -61.82 -17.67 57.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.902 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 1.0 OUTLIER -79.53 -38.49 34.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.518 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -59.27 -38.55 80.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.0 ptmt -169.95 -145.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.564 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.582 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 4.8 mm100 -144.59 -50.04 0.27 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.997 0.427 . . . . 0.0 111.412 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -81.82 71.88 8.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.417 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.988 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.5 mt -73.3 108.94 6.46 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.4 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 4.9 p30 -85.03 176.38 8.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.757 0.313 . . . . 0.0 111.06 -179.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.402 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.5 m -45.9 -29.96 1.57 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.417 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.1 mmpt? -77.65 -48.74 16.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.842 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 mt-10 -70.79 -38.82 73.37 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.892 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.974 ' O ' HG11 ' A' ' 45' ' ' VAL . 2.6 pttt -59.58 -34.33 72.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.017 0.436 . . . . 0.0 110.127 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -90.66 -37.42 13.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.633 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -73.51 -34.53 65.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.553 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.835 HG11 HG13 ' A' ' 19' ' ' VAL . 89.5 t -80.74 -38.8 17.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.402 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.693 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.4 -31.13 72.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.916 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -87.58 -19.95 27.11 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.474 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.02 -24.87 12.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.643 0.259 . . . . 0.0 111.551 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.744 ' SG ' HG22 ' A' ' 19' ' ' VAL . 74.0 m -97.5 -26.67 14.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.291 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.87 25.41 4.53 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.407 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.918 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.55 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.085 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.883 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.94 157.15 40.61 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.883 ' HD2' HG22 ' A' ' 41' ' ' THR . 78.4 Cg_exo -50.41 -24.53 12.28 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.663 2.242 . . . . 0.0 112.269 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.3 tp -89.9 -28.13 19.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.731 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.918 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.8 mm-40 -81.5 -57.98 3.23 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.126 0.488 . . . . 0.0 109.823 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.974 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.7 m -36.32 -32.82 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.615 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.506 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -83.78 -57.98 2.99 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.8 179.665 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.54 HG23 ' N ' ' A' ' 48' ' ' TRP . 21.6 m -68.66 -43.55 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 111.218 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.54 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.66 -53.91 47.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.018 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.988 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.1 m-30 -64.36 -28.9 70.01 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.427 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.2 -52.87 26.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.913 0.387 . . . . 0.0 110.599 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -79.0 -30.59 44.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.638 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.657 ' HB3' HD11 ' A' ' 16' ' ' LEU . 49.7 mmtt -93.89 19.19 9.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.924 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 29.2 ttp180 -177.5 31.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.976 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.2 0 CA-C-O 120.902 0.382 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.682 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.303 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.682 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.9 Cg_endo -51.95 -23.29 16.25 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.759 1.639 . . . . 0.0 111.177 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.79 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -51.2 -23.44 3.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.137 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.69 -57.05 6.0 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.2 0.524 . . . . 0.0 109.852 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -80.99 -34.66 32.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.554 178.931 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.79 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.16 -56.47 12.7 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.239 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.989 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.03 -51.16 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.903 179.595 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.567 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.6 tp -68.53 -31.77 71.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.309 178.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.0 mt-10 -52.47 -57.72 8.99 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.318 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -68.77 -35.99 77.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.899 179.647 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.989 HG23 ' O ' ' A' ' 15' ' ' PHE . 86.6 t -58.52 -64.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-O 120.911 0.386 . . . . 0.0 110.137 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.554 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 63.2 t80 -60.72 -16.19 37.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.169 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.67 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -78.9 -39.21 35.57 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 110.805 179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.5 mtp85 -59.54 -40.34 86.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.884 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.509 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -163.33 -147.87 0.12 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.935 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.554 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 6.5 mm100 -139.05 -49.43 0.51 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.436 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -99.19 91.17 4.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.067 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.877 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.8 mt -78.91 136.74 37.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.101 178.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.72 175.8 6.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.243 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.1 m -51.54 -26.12 7.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.467 . . . . 0.0 110.878 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.426 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -80.01 -47.5 14.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.582 179.673 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.497 ' O ' HG23 ' A' ' 34' ' ' VAL . 2.9 mm-40 -71.63 -37.73 70.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.633 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.965 ' O ' HG11 ' A' ' 45' ' ' VAL . 11.9 pttm -60.29 -35.77 76.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.77 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -89.0 -36.17 15.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.701 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.426 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 8.8 mm-40 -75.18 -36.09 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.728 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.832 HG11 HG13 ' A' ' 19' ' ' VAL . 82.1 t -78.24 -39.37 24.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.01 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.716 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.09 -30.41 71.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.98 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -87.58 -20.52 26.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.443 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 20.2 ptmt -105.07 -26.08 12.26 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.466 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 70.8 m -94.79 -28.2 15.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.101 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.09 23.57 4.85 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.309 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.94 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.78 -162.59 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.113 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.837 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -151.8 153.95 32.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.858 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.837 ' HD2' HG22 ' A' ' 41' ' ' THR . 85.7 Cg_exo -47.28 -26.31 5.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.713 2.275 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.481 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 8.8 tp -88.05 -28.56 21.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.658 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.94 ' HB2' HG22 ' A' ' 40' ' ' ILE . 8.7 mm100 -81.74 -58.14 3.13 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.068 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.965 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.3 m -36.27 -33.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.395 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.525 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -82.05 -58.75 2.83 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.792 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.551 HG23 ' N ' ' A' ' 48' ' ' TRP . 24.3 m -67.82 -43.66 86.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.271 0.558 . . . . 0.0 111.278 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.567 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.77 -54.23 45.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.018 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.877 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -63.7 -29.34 70.58 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 120.674 0.273 . . . . 0.0 110.6 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.4 mm -52.28 -56.06 8.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.747 0.308 . . . . 0.0 110.912 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.405 ' N ' HG22 ' A' ' 50' ' ' ILE . 8.2 m-80 -77.76 -31.16 51.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.506 ' HB3' HD11 ' A' ' 16' ' ' LEU . 52.8 mmtt -90.11 11.63 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.133 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' A' ' 49' ' ' PHE . 9.5 ttp180 -170.57 32.35 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.165 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.965 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.652 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.271 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.652 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.37 -23.9 14.87 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.684 1.589 . . . . 0.0 110.985 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.753 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 97.1 mt-30 -49.35 -26.62 3.28 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.832 179.135 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.08 -55.84 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.338 0.59 . . . . 0.0 110.038 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.402 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -81.49 -36.56 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.612 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.753 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.7 -57.53 7.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.581 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.962 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -54.31 -52.02 62.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.005 179.72 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.663 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.0 tp -64.95 -34.58 78.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.581 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.32 -64.12 0.91 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.362 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -62.75 -34.54 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.974 179.699 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.962 HG23 ' O ' ' A' ' 15' ' ' PHE . 74.9 t -58.58 -65.5 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-O 120.816 0.341 . . . . 0.0 110.137 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -61.34 -15.54 36.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.21 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.581 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.94 -36.27 28.19 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 120.899 0.38 . . . . 0.0 111.063 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -58.87 -37.87 77.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.587 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.451 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.0 ptmt -163.19 -138.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.331 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.436 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 19.5 mm-40 -147.9 -46.5 0.16 Allowed 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.516 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.1 t -100.36 82.92 2.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.054 HD12 ' CE2' ' A' ' 49' ' ' PHE . 5.0 mt -74.95 125.04 28.04 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 176.31 6.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.749 0.309 . . . . 0.0 110.951 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.41 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 37.1 t -45.88 -29.82 1.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.142 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.0 mmpt? -78.19 -48.06 16.7 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.515 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.494 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.7 mt-10 -70.1 -40.15 75.11 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.976 ' O ' HG11 ' A' ' 45' ' ' VAL . 7.3 pttt -58.76 -34.63 71.62 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.16 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.08 -37.01 14.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.678 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -73.88 -34.71 64.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.583 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.821 HG11 HG13 ' A' ' 19' ' ' VAL . 82.4 t -80.29 -38.07 17.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.327 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.682 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.31 -30.9 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.935 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -87.61 -19.22 28.08 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -25.27 13.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 0.0 111.574 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.721 ' SG ' HG22 ' A' ' 19' ' ' VAL . 56.9 m -96.99 -30.22 13.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.064 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.04 22.58 4.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.208 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.917 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -107.05 -163.26 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.87 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -149.98 155.54 37.81 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.674 0.273 . . . . 0.0 111.081 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.87 ' HD2' HG22 ' A' ' 41' ' ' THR . 73.5 Cg_exo -48.79 -29.41 14.77 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.499 2.133 . . . . 0.0 112.037 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.707 HD12 ' HD2' ' A' ' 46' ' ' ARG . 22.5 tp -84.32 -26.93 28.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.683 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.917 ' HB2' HG22 ' A' ' 40' ' ' ILE . 3.5 mm100 -83.35 -59.19 2.54 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.976 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.6 m -36.25 -33.89 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.112 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.791 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -80.68 -58.77 2.95 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.934 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.791 HG13 ' HD3' ' A' ' 46' ' ' ARG . 21.9 m -69.0 -44.28 81.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.361 0.6 . . . . 0.0 111.344 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.565 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.45 -52.8 63.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.023 -179.424 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 1.054 ' CE2' HD12 ' A' ' 26' ' ' LEU . 21.6 m-30 -66.79 -24.76 66.23 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.715 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -55.51 -53.95 30.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.872 0.368 . . . . 0.0 110.369 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -80.83 -30.09 35.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.626 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.663 ' HB3' HD11 ' A' ' 16' ' ' LEU . 63.3 mmtt -93.23 14.94 16.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.021 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.527 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 6.5 ttp180 -178.14 36.37 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.167 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-O 121.051 0.453 . . . . 0.0 110.299 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.66 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.66 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.1 Cg_endo -51.73 -23.08 14.72 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.678 1.585 . . . . 0.0 110.999 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.77 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 96.8 mt-30 -49.85 -25.31 3.03 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.865 179.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.4 -56.23 4.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.313 0.578 . . . . 0.0 109.877 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 2.6 ptt85 -81.37 -37.64 27.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.564 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.77 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.57 -56.83 12.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.926 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -54.03 -51.45 63.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.033 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.666 HD11 ' HB3' ' A' ' 52' ' ' LYS . 1.8 tp -64.46 -34.18 77.61 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.572 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.4 -67.08 0.28 Allowed 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.148 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -35.69 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.073 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.926 HG23 ' O ' ' A' ' 15' ' ' PHE . 71.8 t -56.14 -67.73 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.932 0.396 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.552 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 46.7 t80 -61.26 -15.93 40.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.372 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.07 -37.75 28.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.861 0.363 . . . . 0.0 111.005 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.9 mtp-105 -59.99 -37.52 79.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.637 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.451 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.48 -150.35 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.318 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.552 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 7.2 mm100 -141.68 -46.48 0.36 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.987 0.423 . . . . 0.0 111.489 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.1 t -84.55 77.85 9.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.244 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.987 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.0 mt -80.67 109.86 15.62 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -97.49 -176.12 3.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.301 . . . . 0.0 111.317 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.5 m -48.55 -30.9 5.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.42 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.4 mmpt? -77.0 -48.49 17.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.685 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.0 mm-40 -70.69 -39.15 73.66 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.984 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.974 ' O ' HG11 ' A' ' 45' ' ' VAL . 34.6 pttt -58.44 -34.44 70.83 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.089 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -91.82 -36.69 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.736 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.428 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -74.21 -35.38 63.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.646 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.847 HG11 HG13 ' A' ' 19' ' ' VAL . 91.0 t -79.97 -39.86 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.654 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.75 -30.04 71.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.099 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.41 -19.82 27.54 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.45 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -106.69 -21.74 12.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.632 0.253 . . . . 0.0 111.518 -179.467 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.743 ' SG ' HG22 ' A' ' 19' ' ' VAL . 71.6 m -99.31 -26.62 14.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.259 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.57 26.25 4.58 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.329 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.911 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.57 -167.92 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.262 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.855 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -143.04 155.68 62.11 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 111.076 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.855 ' HD2' HG22 ' A' ' 41' ' ' THR . 77.8 Cg_exo -50.26 -25.13 12.81 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.616 2.211 . . . . 0.0 112.28 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.559 ' O ' HD12 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -89.22 -26.28 21.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.626 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.911 ' HB2' HG22 ' A' ' 40' ' ' ILE . 4.5 mm100 -82.26 -58.83 2.77 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.974 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.3 m -36.62 -33.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.404 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.54 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -81.43 -59.48 2.61 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.681 179.576 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.556 HG23 ' N ' ' A' ' 48' ' ' TRP . 20.4 m -69.21 -44.32 80.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.285 0.565 . . . . 0.0 111.379 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.556 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.43 -51.99 66.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.065 -179.447 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.987 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.7 m-30 -67.05 -27.3 67.28 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.674 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.44 -53.88 21.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.584 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -79.92 -29.52 39.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.666 ' HB3' HD11 ' A' ' 16' ' ' LEU . 63.5 mmtt -93.57 17.41 11.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 49' ' ' PHE . 22.7 ttp180 -178.18 32.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.193 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.4 ttm . . . . . 0 C--N 1.331 -0.198 0 CA-C-O 120.931 0.396 . . . . 0.0 111.069 -179.89 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.684 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.684 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.9 Cg_endo -49.8 -24.04 9.47 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.692 1.595 . . . . 0.0 110.998 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.774 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 93.5 mt-30 -46.46 -27.62 1.14 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.91 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.25 -57.06 3.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 110.074 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.413 ' O ' ' N ' ' A' ' 17' ' ' GLU . 1.2 ptm180 -81.13 -35.43 31.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.771 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.774 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.8 -56.59 11.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 120.985 0.421 . . . . 0.0 111.145 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.985 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -52.63 -50.09 63.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.879 179.353 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.619 HD22 ' CG ' ' A' ' 52' ' ' LYS . 0.5 OUTLIER -67.93 -36.21 79.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.801 178.825 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.625 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.7 mt-10 -48.21 -60.54 2.56 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.157 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -65.11 -35.01 79.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.264 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.985 HG23 ' O ' ' A' ' 15' ' ' PHE . 87.8 t -58.12 -65.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 110.035 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.578 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 19.3 t80 -60.72 -17.83 50.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.949 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.625 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.8 -38.87 53.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.952 0.405 . . . . 0.0 110.84 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.38 -41.79 90.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.644 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -164.23 -144.59 0.08 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.631 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.578 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 4.7 mm100 -145.45 -48.47 0.23 Allowed 'General case' 0 C--N 1.334 -0.081 0 CA-C-O 120.881 0.372 . . . . 0.0 111.563 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.3 t -86.01 73.36 10.31 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.999 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.3 mt -73.16 113.45 10.23 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 6.5 p30 -88.2 178.13 6.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.736 0.303 . . . . 0.0 110.99 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -47.44 -28.68 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.001 0.429 . . . . 0.0 111.045 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.0 OUTLIER -77.1 -50.62 12.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.914 179.883 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.5 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 8.7 mt-10 -70.56 -38.9 74.19 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.82 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.992 ' O ' HG11 ' A' ' 45' ' ' VAL . 19.7 pttt -59.05 -34.89 72.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.151 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -90.5 -37.6 13.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.699 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.04 -34.28 66.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.633 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.842 HG11 HG13 ' A' ' 19' ' ' VAL . 92.7 t -81.75 -38.66 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.629 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.707 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.73 -33.72 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.992 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.8 pttm -87.58 -18.83 28.81 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -25.67 13.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.667 0.27 . . . . 0.0 111.44 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.746 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.8 m -98.51 -29.57 13.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.138 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.28 22.96 3.97 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.415 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.899 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.08 -163.77 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 179.12 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.848 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.98 154.45 39.69 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.788 0.328 . . . . 0.0 110.984 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.848 ' HD2' HG22 ' A' ' 41' ' ' THR . 76.3 Cg_exo -47.98 -27.61 9.08 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.61 2.206 . . . . 0.0 112.289 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.454 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.1 tp -85.83 -28.3 24.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.693 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.899 ' HB2' HG22 ' A' ' 40' ' ' ILE . 9.2 mm100 -82.06 -58.84 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.899 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.992 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.9 m -35.94 -33.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.375 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.691 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -82.29 -56.87 3.65 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.05 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.691 HG13 ' HD3' ' A' ' 46' ' ' ARG . 21.5 m -71.55 -43.79 71.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.254 0.55 . . . . 0.0 111.301 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.555 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.61 -55.03 35.09 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.716 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.999 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.5 m-30 -62.71 -22.52 66.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 120.722 0.296 . . . . 0.0 110.443 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -64.48 -52.01 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.166 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -79.82 -34.59 39.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.05 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.619 ' CG ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -80.27 -26.5 38.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.132 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.484 ' N ' ' O ' ' A' ' 49' ' ' PHE . 8.6 ttm180 -133.24 35.39 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.718 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 4.3 ttm . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.744 179.586 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.658 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.658 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.5 Cg_endo -50.52 -24.32 12.27 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.821 1.681 . . . . 0.0 110.876 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.745 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 97.7 mt-30 -48.46 -25.71 1.79 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.87 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.63 -55.27 5.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 0.0 109.935 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -81.93 -37.11 27.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.861 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.745 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.83 -55.08 21.75 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.506 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.964 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.31 -51.88 65.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.014 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.695 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.8 tp -66.05 -33.56 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.638 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.7 mm-40 -51.29 -64.47 0.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -61.34 -36.4 80.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.481 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.964 HG23 ' O ' ' A' ' 15' ' ' PHE . 93.4 t -58.52 -66.85 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.567 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 65.6 t80 -59.51 -18.24 38.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.818 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.638 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -75.39 -39.8 58.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.982 0.42 . . . . 0.0 110.618 179.796 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.515 ' NH1' HG22 ' A' ' 34' ' ' VAL . 49.0 mtp180 -59.52 -40.0 85.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.706 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.5 ptmt -168.89 -144.75 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.427 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.567 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 1.5 mm100 -144.58 -50.25 0.27 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 111.38 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.8 t -85.83 74.39 10.2 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.986 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.9 mt -72.75 129.4 38.11 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.48 -179.65 4.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.753 0.311 . . . . 0.0 110.655 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.405 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 6.0 m -52.21 -26.94 12.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.19 0.519 . . . . 0.0 110.262 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.44 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.14 -50.23 12.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.61 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.494 ' O ' HG23 ' A' ' 34' ' ' VAL . 1.6 mt-10 -70.67 -39.37 73.6 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.815 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.3 pttp -59.0 -34.88 72.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.224 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -90.31 -37.85 13.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.578 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.44 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 5.0 mm-40 -73.13 -35.62 66.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.621 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.822 HG11 HG13 ' A' ' 19' ' ' VAL . 94.3 t -79.63 -38.5 19.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.163 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.694 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.32 -33.42 75.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.336 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -88.22 -19.95 26.17 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.411 ' CG ' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -101.91 -28.84 12.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.62 -179.111 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.741 ' SG ' HG22 ' A' ' 19' ' ' VAL . 71.4 m -95.9 -29.36 14.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.154 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.94 26.88 2.89 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.344 -0.932 . . . . 0.0 113.579 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.878 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -113.1 -161.91 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.053 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.773 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -149.99 151.25 31.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.495 0.188 . . . . 0.0 110.704 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.773 ' HD2' HG22 ' A' ' 41' ' ' THR . 4.7 Cg_endo -47.12 -27.42 6.31 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.83 2.354 . . . . 0.0 112.195 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 10.5 tp -84.81 -28.74 25.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.525 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.878 ' HB2' HG22 ' A' ' 40' ' ' ILE . 38.8 mm-40 -81.74 -58.1 3.15 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.84 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.2 m -36.2 -33.16 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.581 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.529 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -83.31 -55.85 4.09 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.831 179.662 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.552 HG23 ' N ' ' A' ' 48' ' ' TRP . 28.7 m -70.8 -44.03 76.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.344 0.593 . . . . 0.0 111.368 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.695 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.15 -53.24 58.2 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.124 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.986 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -65.48 -27.41 68.48 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.699 0.285 . . . . 0.0 110.601 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -54.59 -55.17 16.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.804 0.335 . . . . 0.0 110.763 -179.775 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.407 ' N ' HG22 ' A' ' 50' ' ' ILE . 49.5 m-80 -79.53 -29.97 41.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.716 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.437 ' HB3' HD11 ' A' ' 16' ' ' LEU . 23.5 mmtt -90.24 10.53 24.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.15 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.48 ' N ' ' O ' ' A' ' 49' ' ' PHE . 12.1 ttp180 -170.38 32.27 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.491 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-O 120.97 0.414 . . . . 0.0 110.76 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.686 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.686 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.4 Cg_endo -50.87 -24.42 13.58 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.846 1.697 . . . . 0.0 110.965 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.776 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 1.1 mt-30 -49.95 -23.47 2.01 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.031 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.19 -55.8 7.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.143 0.497 . . . . 0.0 109.948 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -81.26 -35.31 31.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.635 178.943 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.776 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.5 -55.29 18.7 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.168 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 1.006 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.08 -50.84 63.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.841 179.526 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.76 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.2 tp -69.14 -32.24 71.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.655 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -51.47 -56.98 10.33 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.117 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -69.38 -34.31 74.35 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.717 179.417 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 1.006 HG23 ' O ' ' A' ' 15' ' ' PHE . 90.7 t -58.54 -67.03 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.843 0.354 . . . . 0.0 110.046 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.404 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 23.8 t80 -59.1 -16.91 21.86 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.951 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.655 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.91 -40.5 47.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.028 0.442 . . . . 0.0 111.046 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.8 -38.82 79.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.035 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.471 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -166.27 -139.58 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.467 179.649 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.471 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 16.0 mm-40 -148.27 -46.88 0.16 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.917 0.389 . . . . 0.0 111.362 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 53' ' ' ARG . 20.8 t -93.61 78.27 4.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.328 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.06 HD12 ' CE2' ' A' ' 49' ' ' PHE . 4.5 mt -74.13 121.36 21.04 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -90.36 177.02 6.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.745 0.307 . . . . 0.0 110.879 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -48.25 -28.19 2.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.952 0.406 . . . . 0.0 111.071 179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 5.6 mmpt? -78.36 -48.4 15.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.635 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 5.2 mt-10 -70.96 -37.78 72.81 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.884 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.978 ' O ' HG11 ' A' ' 45' ' ' VAL . 35.2 pttt -60.3 -34.82 74.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.038 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -90.06 -37.45 14.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.549 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 9.6 mm-40 -73.47 -35.41 65.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.642 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.847 HG11 HG13 ' A' ' 19' ' ' VAL . 86.3 t -80.09 -37.76 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.295 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.683 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.5 -32.02 73.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.477 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.6 ptmt -87.7 -19.34 27.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.328 -0.396 . . . . 0.0 112.032 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.59 -27.37 12.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.624 0.249 . . . . 0.0 111.492 -179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.742 ' SG ' HG22 ' A' ' 19' ' ' VAL . 77.8 m -96.64 -29.0 14.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.24 24.88 4.0 Favored Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.306 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.85 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.4 -165.43 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.06 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.776 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -146.27 151.77 44.98 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 120.573 0.225 . . . . 0.0 110.624 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.776 ' HD2' HG22 ' A' ' 41' ' ' THR . 4.8 Cg_endo -46.9 -29.1 7.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.745 2.296 . . . . 0.0 112.148 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 31.7 tp -82.42 -29.31 30.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.589 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.85 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.4 mm-40 -81.44 -58.91 2.82 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.897 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.978 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.2 m -35.89 -33.39 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.483 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.565 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.5 OUTLIER -82.56 -56.38 3.9 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.793 179.609 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.565 HG13 ' HD3' ' A' ' 46' ' ' ARG . 27.5 m -69.84 -43.3 79.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.402 0.62 . . . . 0.0 111.117 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.76 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.32 -53.78 50.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.982 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 1.06 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.6 m-30 -66.55 -20.49 66.03 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.657 0.265 . . . . 0.0 110.741 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -59.85 -59.99 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.181 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.488 ' N ' HG22 ' A' ' 50' ' ' ILE . 5.5 p30 -72.94 -43.1 62.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.406 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.506 ' HG3' HD22 ' A' ' 16' ' ' LEU . 43.5 mmtt -71.18 -33.64 70.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.595 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.581 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 2.3 tmt_? -123.13 34.59 5.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.471 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 4.9 ttp . . . . . 0 C--N 1.332 -0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.916 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.686 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.686 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.7 Cg_endo -50.39 -25.02 13.04 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 121.78 1.654 . . . . 0.0 111.082 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.752 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.7 OUTLIER -50.79 -23.67 2.91 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.79 179.115 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.89 -54.51 12.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.157 0.503 . . . . 0.0 109.814 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -36.52 27.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.723 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.752 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.22 -54.06 35.11 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.574 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.959 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -58.03 -52.5 65.26 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.659 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.5 tp -63.25 -32.58 74.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.81 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.516 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -53.66 -66.59 0.37 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.097 179.332 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.63 -27.42 66.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.959 HG23 ' O ' ' A' ' 15' ' ' PHE . 98.0 t -70.69 -63.28 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.06 0.457 . . . . 0.0 110.731 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.406 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 61.0 t80 -68.42 -11.51 59.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.544 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.516 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -85.73 -36.62 20.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.57 -179.688 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.229 0.538 . . . . 0.0 110.218 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -162.37 -143.1 0.08 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.951 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.406 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 20.1 mm-40 -147.07 -44.82 0.18 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.543 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -101.54 90.39 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.04 HD12 ' CE2' ' A' ' 49' ' ' PHE . 6.7 mt -86.0 130.54 34.51 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.421 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 3.2 p30 -95.48 -176.65 3.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.426 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 11.3 t -52.13 -29.26 21.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.31 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.02 -47.74 17.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.6 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.517 ' O ' HG23 ' A' ' 34' ' ' VAL . 23.9 mt-10 -72.05 -36.99 69.76 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.818 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.966 ' O ' HG11 ' A' ' 45' ' ' VAL . 4.3 pttp -60.89 -34.24 74.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.02 0.438 . . . . 0.0 109.947 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -90.02 -36.39 14.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.534 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -74.94 -35.11 62.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.59 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.815 HG11 HG13 ' A' ' 19' ' ' VAL . 93.3 t -80.12 -36.78 16.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.666 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.84 -29.64 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.503 . . . . 0.0 112.078 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -87.23 -19.92 27.66 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 5.3 ptmm? -103.93 -26.85 12.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.686 0.279 . . . . 0.0 111.513 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 61.2 m -95.21 -27.72 15.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 113.24 24.72 4.68 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.321 -0.943 . . . . 0.0 113.404 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.953 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.55 -165.36 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.163 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.882 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -146.52 158.02 47.43 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 120.769 0.318 . . . . 0.0 111.203 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.882 ' HD2' HG22 ' A' ' 41' ' ' THR . 56.6 Cg_exo -51.61 -23.76 15.79 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.647 2.231 . . . . 0.0 112.374 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.2 tp -91.6 -25.51 19.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.745 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.953 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.4 mm-40 -82.99 -58.54 2.82 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 109.882 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.966 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.7 m -36.53 -33.23 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.218 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.525 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.75 -59.74 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.767 179.563 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.55 HG23 ' N ' ' A' ' 48' ' ' TRP . 20.6 m -68.53 -44.06 83.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.224 0.535 . . . . 0.0 111.38 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.55 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.41 -54.05 48.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.962 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 1.04 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.8 m-30 -64.23 -29.61 70.71 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.458 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -52.84 -51.68 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.908 0.385 . . . . 0.0 110.573 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -79.63 -29.52 41.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.548 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.659 ' HB3' HD11 ' A' ' 16' ' ' LEU . 52.6 mmtt -94.84 18.36 11.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.9 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' PHE . 12.6 ttp180 -176.27 30.63 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.207 0 CA-C-O 120.866 0.365 . . . . 0.0 110.99 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.1 Cg_endo -52.92 -22.81 19.28 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 121.589 1.526 . . . . 0.0 111.028 179.165 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.81 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 95.1 mt-30 -49.76 -26.95 4.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.547 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.472 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -41.66 -59.68 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.249 0.547 . . . . 0.0 110.121 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -81.51 -35.21 30.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.701 178.842 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.81 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.2 -57.73 8.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.234 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.888 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -55.35 -45.06 76.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.504 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.564 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -69.9 -31.69 69.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.911 179.123 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.6 OUTLIER -54.36 -64.61 0.78 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.581 179.049 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -32.33 69.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.304 178.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 15' ' ' PHE . 25.0 t -59.02 -57.24 12.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.991 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.518 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 9.0 t80 -73.41 -11.8 60.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.739 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.13 -37.4 28.91 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.504 179.665 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -60.24 -42.1 94.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.335 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.464 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -160.64 -155.3 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.473 179.746 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.518 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 6.2 mm100 -139.72 -47.99 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 111.551 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 t -77.9 73.77 4.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.455 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.96 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.7 OUTLIER -80.32 115.72 20.01 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.502 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.59 -177.26 3.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.732 0.301 . . . . 0.0 110.626 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.412 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 0.9 OUTLIER -52.1 -26.48 11.26 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.147 0.499 . . . . 0.0 110.604 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.418 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.54 -49.39 13.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.827 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.0 mm-40 -72.29 -36.45 68.97 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.798 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.979 ' O ' HG11 ' A' ' 45' ' ' VAL . 31.7 pttt -60.67 -34.99 75.13 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.077 0.465 . . . . 0.0 109.882 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -90.1 -35.61 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.69 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -75.54 -35.46 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.741 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.827 HG11 HG13 ' A' ' 19' ' ' VAL . 83.4 t -79.46 -39.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.311 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.736 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -60.81 -34.33 74.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.753 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -87.95 -19.11 27.7 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -19.8 13.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.118 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.778 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.9 m -106.34 -27.15 11.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.32 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.3 21.87 4.3 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 120.124 -1.036 . . . . 0.0 114.037 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.929 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.27 -164.77 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.05 0.425 . . . . 0.0 110.166 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.876 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.8 156.98 41.24 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.676 0.275 . . . . 0.0 110.931 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.876 ' HD2' HG22 ' A' ' 41' ' ' THR . 74.1 Cg_exo -49.67 -26.87 13.79 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.62 2.213 . . . . 0.0 112.496 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.4 tp -88.91 -29.01 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 0.0 110.562 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.929 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.8 mm-40 -80.57 -58.23 3.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.77 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.979 HG11 ' O ' ' A' ' 31' ' ' LYS . 22.7 m -35.73 -35.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.508 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.537 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -79.7 -55.39 5.04 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.667 179.526 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.566 HG23 ' N ' ' A' ' 48' ' ' TRP . 29.7 m -69.84 -44.27 79.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.457 0.646 . . . . 0.0 111.202 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.566 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -62.43 -51.49 67.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.211 -179.459 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.96 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.5 m-30 -67.57 -25.73 65.94 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.525 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -56.96 -50.58 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.953 0.406 . . . . 0.0 110.375 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -80.42 -32.23 37.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.523 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -92.95 16.1 13.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.027 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -178.15 35.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.11 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.407 . . . . 0.0 110.654 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.681 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.329 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -52.09 -23.69 17.93 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.81 1.674 . . . . 0.0 110.952 179.098 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.807 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 2.9 mp0 -52.12 -24.94 7.73 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.661 179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.99 -59.22 2.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.265 0.555 . . . . 0.0 110.081 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -82.07 -34.97 29.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.668 178.858 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.807 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.71 -53.91 43.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.011 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.987 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -57.0 -46.97 81.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.34 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.581 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -69.86 -30.03 67.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.264 179.172 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.522 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.9 mt-10 -54.88 -62.8 1.42 Allowed 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.533 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -60.76 -30.97 70.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.986 178.677 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.987 HG23 ' O ' ' A' ' 15' ' ' PHE . 54.4 t -61.76 -61.88 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.423 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 34.4 t80 -65.6 -14.86 62.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.638 178.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.522 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.27 -40.13 52.53 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.97 0.414 . . . . 0.0 110.493 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.654 ' NH1' HG22 ' A' ' 34' ' ' VAL . 37.7 mtp180 -59.12 -42.96 91.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.719 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.48 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -161.48 -145.61 0.11 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.55 179.372 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.12 -50.54 0.43 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.026 0.441 . . . . 0.0 111.589 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -95.29 81.27 3.6 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.943 HD12 ' CE2' ' A' ' 49' ' ' PHE . 4.4 mt -74.5 135.61 42.21 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.9 -178.64 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.416 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 1.3 m -51.13 -27.4 8.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.194 0.521 . . . . 0.0 110.439 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.79 -50.36 11.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.871 179.852 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.513 ' O ' HG23 ' A' ' 34' ' ' VAL . 5.3 mt-10 -71.02 -37.99 72.6 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.046 0.45 . . . . 0.0 109.795 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.967 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.7 pttp -60.5 -34.84 74.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.954 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.53 -35.95 15.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.625 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -75.28 -35.74 61.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.575 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.82 HG11 HG13 ' A' ' 19' ' ' VAL . 85.6 t -78.67 -37.47 20.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.102 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.722 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.47 -30.83 71.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.037 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -87.48 -19.89 27.33 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.1 OUTLIER -105.37 -23.31 12.87 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.499 -179.398 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 64.3 m -98.68 -28.27 13.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.37 21.76 5.06 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.363 -0.922 . . . . 0.0 113.454 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.908 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.14 -163.37 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.894 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.92 157.66 35.41 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.693 0.282 . . . . 0.0 111.104 -179.921 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.894 ' HD2' HG22 ' A' ' 41' ' ' THR . 77.1 Cg_exo -50.27 -25.01 12.63 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.498 2.132 . . . . 0.0 112.249 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.519 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -89.33 -30.28 18.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.588 179.607 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.908 ' HB2' HG22 ' A' ' 40' ' ' ILE . 32.8 mm-40 -80.47 -58.27 3.2 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.856 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.967 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.0 m -34.69 -41.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.841 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -71.56 -60.48 2.21 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.719 179.063 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.572 HG22 ' HA ' ' A' ' 44' ' ' GLN . 15.3 m -63.38 -44.13 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 121.264 0.554 . . . . 0.0 111.259 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.581 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -61.99 -53.64 52.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.957 -179.38 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.943 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.7 m-85 -68.59 -18.72 64.38 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 120.667 0.27 . . . . 0.0 110.858 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -62.39 -55.75 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.846 0.355 . . . . 0.0 110.379 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.449 ' N ' HG22 ' A' ' 50' ' ' ILE . 5.9 m-80 -78.14 -34.07 50.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.217 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.437 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 49.1 mmtt -77.84 -31.88 51.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.133 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 49' ' ' PHE . 8.1 ttp180 -125.36 31.89 5.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.424 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.292 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -53.46 -22.3 20.98 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 121.62 1.547 . . . . 0.0 110.961 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.794 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 94.5 mt-30 -50.09 -26.32 4.34 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.807 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -41.94 -58.38 2.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.286 0.565 . . . . 0.0 110.125 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -37.67 26.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.779 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.794 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -61.32 -56.08 24.5 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.831 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.96 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.1 -48.86 67.47 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.675 179.143 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.571 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -67.22 -30.06 69.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.201 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -55.78 -65.37 0.61 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.57 179.064 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -59.35 -28.86 67.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.371 178.909 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.96 HG23 ' O ' ' A' ' 15' ' ' PHE . 42.0 t -62.38 -60.26 3.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.342 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.415 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 26.9 t80 -68.94 -13.02 62.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -83.69 -35.01 24.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.903 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 46.2 mtp85 -59.46 -39.52 83.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.176 0.512 . . . . 0.0 110.313 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.495 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -158.62 -145.5 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.394 179.177 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.457 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.72 -50.6 0.41 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.078 0.466 . . . . 0.0 111.59 -179.032 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.2 t -95.63 81.25 3.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.724 -178.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.914 HD12 ' CE2' ' A' ' 49' ' ' PHE . 3.7 mt -73.42 117.13 14.8 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -93.45 175.69 6.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.647 0.261 . . . . 0.0 110.871 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.5 m -44.66 -29.85 0.82 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.997 0.427 . . . . 0.0 111.131 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.7 mmpt? -78.01 -48.6 15.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.763 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.3 mt-10 -71.14 -37.96 72.26 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.979 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 13.3 pttt -60.74 -34.14 73.98 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.65 -36.58 15.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.406 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.8 mm-40 -74.5 -35.82 63.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.487 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.829 HG11 HG13 ' A' ' 19' ' ' VAL . 75.3 t -78.33 -37.82 22.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.017 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.735 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.15 -31.16 72.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.059 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ptmt -87.47 -19.76 27.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.45 -23.55 12.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.585 0.231 . . . . 0.0 111.571 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.733 ' SG ' HG22 ' A' ' 19' ' ' VAL . 61.0 m -99.78 -25.56 14.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.482 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.23 26.9 4.13 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.304 -0.95 . . . . 0.0 113.582 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.91 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -115.48 -164.22 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.067 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.875 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.38 159.15 35.39 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.31 . . . . 0.0 111.135 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.875 ' HD2' HG22 ' A' ' 41' ' ' THR . 65.9 Cg_exo -51.27 -24.45 15.56 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.527 2.151 . . . . 0.0 112.304 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.826 ' O ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -89.73 -31.28 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.181 179.666 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.91 ' HB2' HG22 ' A' ' 40' ' ' ILE . 26.8 mm-40 -79.63 -58.15 3.33 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.802 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 23.9 m -35.14 -43.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.019 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.481 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -70.29 -59.61 2.77 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.922 179.362 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.563 HG23 ' N ' ' A' ' 48' ' ' TRP . 19.0 m -65.21 -45.22 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 121.235 0.54 . . . . 0.0 111.522 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.571 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.87 -52.74 63.76 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.001 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.914 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.4 m-85 -67.85 -25.39 65.52 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.628 0.252 . . . . 0.0 110.805 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -56.46 -53.92 34.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -79.84 -29.2 40.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.685 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.468 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 15.0 mmtt -93.0 12.64 23.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.173 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 11.6 ttp180 -174.35 34.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ttm . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 110.912 -179.881 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.681 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.2 Cg_endo -50.57 -22.47 9.26 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.553 1.502 . . . . 0.0 111.076 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.738 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 95.1 mt-30 -47.79 -25.62 1.33 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.948 179.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.41 -55.87 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 109.987 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.11 -35.73 31.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.974 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.738 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.46 -54.46 23.84 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.248 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.993 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.32 -49.25 67.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.977 179.532 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.631 HD22 ' CG ' ' A' ' 52' ' ' LYS . 0.4 OUTLIER -71.15 -33.88 70.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.914 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.681 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.3 mm-40 -49.72 -54.82 16.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.172 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -70.21 -33.86 72.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.402 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.993 HG23 ' O ' ' A' ' 15' ' ' PHE . 97.9 t -59.63 -65.42 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -60.75 -18.68 56.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.775 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.681 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.5 OUTLIER -72.61 -41.8 65.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.43 . . . . 0.0 110.358 179.654 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -61.26 -41.33 96.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.506 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -169.07 -156.78 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.24 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -134.56 -51.01 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.99 0.424 . . . . 0.0 111.607 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.6 t -84.12 78.54 9.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.52 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.909 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.8 mt -76.04 134.25 40.14 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.27 178.78 4.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.673 0.273 . . . . 0.0 110.416 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.403 ' HB2' ' HE2' ' A' ' 29' ' ' LYS . 3.4 m -51.23 -27.11 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.215 0.531 . . . . 0.0 110.405 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.11 -51.27 10.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.839 179.87 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.496 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.3 mt-10 -70.53 -39.1 74.24 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.834 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.983 ' O ' HG11 ' A' ' 45' ' ' VAL . 9.5 pttt -59.19 -35.24 73.23 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.72 -37.97 14.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.494 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 11.0 mm-40 -72.9 -35.09 67.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.764 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.829 HG11 HG13 ' A' ' 19' ' ' VAL . 85.0 t -79.81 -39.11 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.317 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.96 -29.85 70.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.125 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -87.31 -21.91 25.45 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 9.8 ptmt -102.72 -30.45 10.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.73 0.3 . . . . 0.0 111.396 -179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.755 ' SG ' HG22 ' A' ' 19' ' ' VAL . 75.7 m -90.42 -29.9 17.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.047 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.33 21.5 5.16 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.355 -0.926 . . . . 0.0 113.408 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.881 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -106.5 -161.96 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.879 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -152.31 155.35 33.03 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 111.119 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.879 ' HD2' HG22 ' A' ' 41' ' ' THR . 71.0 Cg_exo -48.86 -25.91 9.14 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.572 2.181 . . . . 0.0 112.306 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 4.9 tp -87.86 -28.97 21.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.593 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.881 ' HB2' HG22 ' A' ' 40' ' ' ILE . 8.8 mm100 -82.44 -58.53 2.89 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.984 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.983 HG11 ' O ' ' A' ' 31' ' ' LYS . 24.6 m -35.9 -34.09 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.202 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.771 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -81.2 -58.8 2.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.078 179.482 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.771 HG13 ' HD3' ' A' ' 46' ' ' ARG . 20.0 m -70.11 -44.57 78.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.276 0.56 . . . . 0.0 111.448 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.562 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -60.33 -55.68 30.7 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.655 -179.595 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.909 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -61.44 -26.9 68.18 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.488 178.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.9 mm -59.62 -51.83 68.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.329 . . . . 0.0 110.485 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -80.59 -39.39 27.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.215 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.631 ' CG ' HD22 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -75.2 -21.94 58.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.225 -179.785 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 7.2 ttm180 -134.96 30.21 3.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.564 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.415 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.8 ttp . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 120.88 0.371 . . . . 0.0 111.033 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.669 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.177 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.669 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.3 Cg_endo -51.06 -23.97 13.47 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 121.638 1.558 . . . . 0.0 110.895 179.077 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.792 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 98.0 mt-30 -47.96 -27.27 2.11 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.858 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.426 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -42.92 -57.8 2.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.23 0.538 . . . . 0.0 110.04 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.446 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.86 -34.15 30.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.768 178.886 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.792 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.41 -57.5 7.27 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.998 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -53.13 -47.99 68.26 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.168 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.844 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -67.61 -39.46 84.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.812 178.675 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.639 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.7 mm-40 -45.88 -61.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.338 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -64.61 -34.22 77.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.386 179.169 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.998 HG23 ' O ' ' A' ' 15' ' ' PHE . 54.9 t -57.77 -65.9 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.108 0.48 . . . . 0.0 109.896 178.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.594 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 41.3 t80 -62.26 -15.0 44.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.711 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -81.07 -36.92 29.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.921 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.48 -37.24 77.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.074 0.464 . . . . 0.0 110.501 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -167.8 -143.95 0.05 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.494 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.594 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 6.5 mm100 -145.82 -48.75 0.22 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.007 0.432 . . . . 0.0 111.59 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 t -83.24 71.08 10.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.342 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.0 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.7 mt -74.1 110.65 8.56 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.04 179.8 5.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.189 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.407 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 1.9 m -44.92 -30.61 1.04 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.737 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.1 mmpt? -78.25 -48.86 14.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.932 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.6 mt-10 -71.4 -37.92 71.48 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.816 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.939 ' O ' HG11 ' A' ' 45' ' ' VAL . 32.3 pttt -59.66 -34.97 73.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.049 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -90.18 -37.21 14.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.574 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.1 mm-40 -73.57 -35.3 65.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.639 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.85 HG11 HG13 ' A' ' 19' ' ' VAL . 75.8 t -79.01 -40.71 22.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.36 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.688 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -61.05 -31.25 70.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.006 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -87.63 -19.45 27.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.457 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -105.5 -23.42 12.81 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.543 -179.403 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.75 ' SG ' HG22 ' A' ' 19' ' ' VAL . 60.8 m -99.42 -28.39 13.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.274 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.55 20.39 5.45 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.709 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.889 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -106.61 -167.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 178.987 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.858 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -144.19 155.53 58.15 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.293 . . . . 0.0 111.119 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.858 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.6 Cg_exo -49.41 -25.92 11.1 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.702 2.268 . . . . 0.0 112.524 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.51 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -89.01 -27.1 21.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.08 0.467 . . . . 0.0 110.784 179.78 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.889 ' HB2' HG22 ' A' ' 40' ' ' ILE . 38.6 mm-40 -81.89 -58.96 2.75 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.817 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.939 HG11 ' O ' ' A' ' 31' ' ' LYS . 25.6 m -36.7 -34.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.186 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.7 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -78.71 -62.75 1.59 Allowed 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.031 179.577 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.7 HG13 ' HD3' ' A' ' 46' ' ' ARG . 11.1 m -70.27 -46.9 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 111.67 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.844 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.57 -48.41 77.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.612 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 1.0 ' CE2' HD12 ' A' ' 26' ' ' LEU . 15.9 m-30 -65.62 -31.86 73.13 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.905 179.151 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.695 HG12 ' O ' ' A' ' 46' ' ' ARG . 2.7 mm -49.75 -52.34 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.97 0.414 . . . . 0.0 110.566 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.37 -33.67 48.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.145 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.472 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 22.9 mmtt -95.54 22.87 6.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.168 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 49' ' ' PHE . 5.3 ttp180 -178.9 29.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.315 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.332 -0.17 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.671 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.248 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.671 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 12.4 Cg_endo -54.52 -20.85 22.16 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 121.658 1.572 . . . . 0.0 110.945 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.759 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 2.8 mp0 -53.18 -23.22 7.87 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.891 179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.43 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -46.06 -58.28 3.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.274 0.559 . . . . 0.0 110.114 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.78 -35.65 32.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.702 179.02 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.759 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.51 -51.12 62.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.405 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.913 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -56.5 -48.06 77.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.372 179.936 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.966 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -75.39 -27.34 59.05 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.177 179.344 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.523 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.1 mt-10 -54.25 -59.46 4.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -62.65 -32.16 73.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.989 178.751 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.913 HG23 ' O ' ' A' ' 15' ' ' PHE . 55.8 t -60.27 -59.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.411 179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.428 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 18.5 t80 -68.52 -14.01 62.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.901 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.64 -36.17 26.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.857 0.36 . . . . 0.0 110.558 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -60.84 -37.92 83.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.57 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.488 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 1.1 ptmm? -164.44 -147.91 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.372 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.488 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 27.6 mm-40 -146.34 -48.53 0.2 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.903 0.382 . . . . 0.0 111.675 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.3 t -83.18 73.64 10.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.983 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.0 OUTLIER -74.65 117.0 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.99 177.09 6.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.875 0.369 . . . . 0.0 110.934 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.402 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 2.4 m -47.93 -29.14 3.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.161 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 3.4 mmpt? -78.23 -48.55 15.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.793 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.513 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.2 mt-10 -71.75 -36.83 70.55 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.946 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.976 ' O ' HG11 ' A' ' 45' ' ' VAL . 16.1 pttt -61.54 -34.55 75.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.001 0.429 . . . . 0.0 110.057 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -89.83 -36.44 15.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.505 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 7.3 mm-40 -74.72 -35.53 62.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.683 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.799 HG11 HG13 ' A' ' 19' ' ' VAL . 79.6 t -79.16 -38.92 20.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.245 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.714 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.1 -31.68 72.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.95 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -87.71 -20.21 26.55 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.486 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 1.4 pttp -105.35 -24.19 12.71 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.529 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.751 ' SG ' HG22 ' A' ' 19' ' ' VAL . 77.0 m -98.15 -27.77 14.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.228 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.77 23.85 4.19 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.16 -1.019 . . . . 0.0 113.702 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.886 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.01 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.953 0.376 . . . . 0.0 110.117 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.885 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -147.67 157.11 44.8 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.775 0.321 . . . . 0.0 111.003 179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.885 ' HD2' HG22 ' A' ' 41' ' ' THR . 65.1 Cg_exo -51.19 -23.99 14.2 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.58 2.187 . . . . 0.0 112.3 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -91.38 -28.3 17.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.1 0.476 . . . . 0.0 110.757 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.886 ' HB2' HG22 ' A' ' 40' ' ' ILE . 3.9 mm100 -80.97 -57.0 3.73 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.976 HG11 ' O ' ' A' ' 31' ' ' LYS . 18.6 m -36.23 -36.4 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.117 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -78.14 -57.57 3.72 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.834 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.569 HG23 ' N ' ' A' ' 48' ' ' TRP . 21.0 m -68.27 -44.87 83.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.214 0.531 . . . . 0.0 111.451 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.966 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.05 -53.2 60.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.958 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.983 ' CE2' HD12 ' A' ' 26' ' ' LEU . 23.0 m-30 -66.46 -28.9 68.95 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.672 0.272 . . . . 0.0 110.521 179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -54.93 -52.74 40.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.861 0.362 . . . . 0.0 110.562 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -78.01 -29.07 49.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.159 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.765 ' HG3' HD22 ' A' ' 16' ' ' LEU . 35.5 mmtt -94.87 19.0 10.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.791 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 49' ' ' PHE . 11.1 ttp-105 -178.34 33.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.061 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 ttm . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.01 0.433 . . . . 0.0 110.72 -179.915 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.696 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.696 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.3 Cg_endo -50.85 -23.93 12.61 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.904 1.736 . . . . 0.0 110.949 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.79 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -50.34 -22.77 1.96 Allowed 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.083 179.047 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -48.12 -56.88 6.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.298 0.571 . . . . 0.0 109.747 178.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.425 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -81.22 -34.41 32.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.712 179.039 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.79 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.54 -48.41 69.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.411 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.969 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -58.81 -45.1 90.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.889 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.837 HD21 ' HB3' ' A' ' 52' ' ' LYS . 24.1 tp -76.13 -30.78 58.33 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.926 178.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.575 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 2.5 mt-10 -52.23 -43.45 64.31 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.83 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -81.77 -28.21 33.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.584 179.242 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.969 HG23 ' O ' ' A' ' 15' ' ' PHE . 86.6 t -67.2 -64.02 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.876 0.37 . . . . 0.0 110.388 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.457 ' CE2' ' HG3' ' A' ' 53' ' ' ARG . 11.0 t80 -60.4 -26.47 66.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.772 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -77.43 -42.63 35.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.498 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.6 mtp85 -59.74 -40.13 87.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.499 . . . . 0.0 110.194 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.479 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.22 -160.35 0.54 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.519 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.428 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 4.6 mm100 -141.99 -46.63 0.35 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.207 0.527 . . . . 0.0 111.526 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.9 t -74.99 71.38 2.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.158 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.759 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -76.78 109.51 10.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.958 178.864 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 -179.15 4.65 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.403 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 9.6 t -50.74 -28.43 9.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.187 0.517 . . . . 0.0 110.347 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.445 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.01 -50.91 11.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.958 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.499 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.0 mm-40 -70.89 -38.41 73.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.032 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.991 ' O ' HG11 ' A' ' 45' ' ' VAL . 6.4 pttp -60.23 -34.68 74.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.025 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.81 -37.19 13.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.584 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.5 mm-40 -73.8 -37.34 64.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.872 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.818 HG11 HG13 ' A' ' 19' ' ' VAL . 93.3 t -78.18 -40.0 25.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.299 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.703 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -60.95 -31.74 71.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.443 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -88.06 -19.9 26.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.422 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -103.34 -25.73 13.19 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.646 -179.35 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.73 ' SG ' HG22 ' A' ' 19' ' ' VAL . 70.9 m -98.27 -28.71 13.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.139 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.73 20.69 4.89 Favored Glycine 0 C--N 1.33 0.21 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.504 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.944 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -105.77 -163.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.887 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.49 157.2 42.01 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.692 0.282 . . . . 0.0 111.074 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.887 ' HD2' HG22 ' A' ' 41' ' ' THR . 63.2 Cg_exo -51.52 -23.8 15.43 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.599 2.199 . . . . 0.0 112.281 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.493 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -90.7 -27.23 19.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.056 0.455 . . . . 0.0 110.694 179.693 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.944 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.7 mm-40 -81.5 -59.5 2.6 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.829 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.991 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.5 m -35.82 -32.96 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.445 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.512 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.77 -59.94 2.42 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.6 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.555 HG23 ' N ' ' A' ' 48' ' ' TRP . 19.9 m -67.95 -43.86 85.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.359 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.555 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.0 -54.08 46.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.042 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.759 ' CE2' HD12 ' A' ' 26' ' ' LEU . 21.6 m-30 -65.88 -24.61 66.89 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.704 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -55.49 -58.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.677 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.456 ' N ' HG22 ' A' ' 50' ' ' ILE . 73.5 m-20 -79.17 -32.4 44.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.051 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.837 ' HB3' HD21 ' A' ' 16' ' ' LEU . 13.6 mmtt -85.15 1.02 49.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.539 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -164.93 37.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.971 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.3 ttp . . . . . 0 C--N 1.328 -0.326 0 CA-C-O 120.976 0.417 . . . . 0.0 110.822 179.939 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.669 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.283 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.669 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.55 -24.25 12.24 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.607 1.538 . . . . 0.0 111.087 179.22 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.727 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 96.7 mt-30 -48.83 -26.85 2.63 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.579 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.95 -55.05 5.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.219 0.533 . . . . 0.0 110.025 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.54 -36.34 29.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.678 178.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.727 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.51 -57.44 7.31 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.515 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.972 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.73 -49.09 68.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.93 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.741 HD13 ' CE3' ' A' ' 48' ' ' TRP . 2.2 tp -68.91 -34.15 74.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.098 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -49.97 -59.53 3.79 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.159 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.31 -37.1 84.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.758 179.476 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.972 HG23 ' O ' ' A' ' 15' ' ' PHE . 93.0 t -56.12 -68.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.831 0.348 . . . . 0.0 110.085 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -16.29 15.92 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.989 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.67 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -80.0 -37.96 33.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.745 0.307 . . . . 0.0 111.223 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 -59.06 -37.33 76.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.468 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.2 ptmt -167.15 -145.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.537 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.439 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -140.68 -50.25 0.45 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.928 0.395 . . . . 0.0 111.716 -179.131 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.6 78.57 4.31 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.049 HD12 ' CE2' ' A' ' 49' ' ' PHE . 5.1 mt -72.3 124.71 25.65 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -98.01 176.89 5.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.756 0.312 . . . . 0.0 111.145 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.426 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 12.0 t -44.69 -31.17 1.09 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.8 mmpt? -78.66 -47.22 17.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.914 0.388 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.503 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.2 mt-10 -70.69 -38.34 73.68 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.81 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 7.1 pttt -59.95 -34.98 73.99 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -89.72 -37.38 14.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.545 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -73.05 -35.73 66.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.555 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.835 HG11 HG13 ' A' ' 19' ' ' VAL . 80.1 t -79.48 -38.16 19.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.252 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.6 -31.87 73.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.441 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -87.82 -19.6 27.24 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -26.2 13.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.661 0.267 . . . . 0.0 111.566 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.725 ' SG ' HG22 ' A' ' 19' ' ' VAL . 86.2 m -97.6 -28.44 13.94 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.299 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.42 23.33 4.48 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.35 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.877 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.8 -163.89 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.086 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.771 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.0 OUTLIER -149.18 153.02 37.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.591 0.234 . . . . 0.0 110.809 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.771 ' HD2' HG22 ' A' ' 41' ' ' THR . 5.0 Cg_endo -47.38 -26.97 6.47 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.827 2.351 . . . . 0.0 112.239 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.475 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.6 OUTLIER -84.1 -30.33 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.588 179.641 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.877 ' HB2' HG22 ' A' ' 40' ' ' ILE . 3.2 mm100 -81.77 -57.55 3.39 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.779 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 22.8 m -36.69 -32.75 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.422 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.751 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.5 OUTLIER -83.32 -56.5 3.73 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.886 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.751 HG13 ' HD3' ' A' ' 46' ' ' ARG . 28.2 m -69.8 -42.82 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.376 0.608 . . . . 0.0 111.178 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.741 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -63.33 -55.86 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.829 -179.53 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 1.049 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.1 m-30 -64.15 -18.87 64.87 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-O 120.682 0.277 . . . . 0.0 110.588 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -64.45 -55.36 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.893 0.377 . . . . 0.0 110.388 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.404 ' N ' HG22 ' A' ' 50' ' ' ILE . 21.4 m-80 -77.72 -34.9 52.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.916 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.562 ' HG3' HD22 ' A' ' 16' ' ' LEU . 15.2 mmtt -81.47 -19.56 42.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.132 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.489 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 8.9 ttm180 -145.04 44.03 1.33 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.741 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.996 0.427 . . . . 0.0 110.48 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.678 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.293 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.678 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.7 Cg_endo -50.75 -24.38 13.13 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.936 1.757 . . . . 0.0 111.02 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.879 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 1.3 mt-30 -49.98 -26.33 4.15 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.837 179.091 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.45 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -41.7 -59.76 1.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.303 0.573 . . . . 0.0 110.058 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.438 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.32 -33.93 28.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.517 178.674 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.879 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.69 -58.19 6.96 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.344 -179.243 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.884 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -57.73 -45.15 86.19 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.578 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -67.59 -36.17 80.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.022 0.439 . . . . 0.0 109.963 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.8 mt-10 -50.03 -66.4 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.701 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -58.69 -34.78 71.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 15' ' ' PHE . 34.4 t -58.31 -59.08 4.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.0 0.428 . . . . 0.0 110.243 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.449 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 5.1 t80 -69.75 -12.92 62.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.144 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -84.82 -37.39 20.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.858 0.361 . . . . 0.0 110.955 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.42 -37.11 84.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.652 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.614 ' HD2' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -160.01 -164.76 1.35 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.546 179.851 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 20' ' ' PHE . 40.8 mm-40 -137.78 -20.88 1.13 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.227 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.8 t -102.89 74.33 1.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.612 HD21 ' HD3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -71.5 97.57 1.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.324 178.754 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.457 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -88.46 172.17 9.56 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.257 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.9 t -44.53 -31.21 1.04 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.1 mmpt? -78.18 -49.75 13.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.833 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 34' ' ' VAL . 1.9 mm-40 -68.94 -41.82 77.57 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.913 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.97 ' O ' HG11 ' A' ' 45' ' ' VAL . 6.9 pttp -57.52 -35.48 70.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.29 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.403 ' HG3' ' N ' ' A' ' 33' ' ' GLU . 7.6 pt-20 -89.04 -37.57 15.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.58 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.432 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.2 mm-40 -73.48 -35.52 65.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.602 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.803 HG11 HG13 ' A' ' 19' ' ' VAL . 81.2 t -79.42 -38.41 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.298 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.713 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.45 -35.09 78.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.456 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.12 -19.69 26.66 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.094 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -102.58 -25.47 13.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.061 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.773 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.5 m -101.64 -28.3 12.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.305 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.08 23.85 3.45 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.251 -0.976 . . . . 0.0 114.096 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.942 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.8 -163.13 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 178.924 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.865 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.92 154.13 34.06 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 0.0 110.945 180.0 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.865 ' HD2' HG22 ' A' ' 41' ' ' THR . 85.8 Cg_exo -47.42 -27.12 6.79 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.707 2.271 . . . . 0.0 112.382 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.559 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -88.47 -29.96 19.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.501 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.942 ' HB2' HG22 ' A' ' 40' ' ' ILE . 33.7 mm-40 -80.38 -58.75 2.98 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.775 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.97 HG11 ' O ' ' A' ' 31' ' ' LYS . 26.9 m -34.79 -40.36 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.817 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -71.54 -61.58 1.72 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.783 179.264 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.542 HG23 ' N ' ' A' ' 48' ' ' TRP . 16.8 m -64.6 -43.59 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 121.427 0.632 . . . . 0.0 111.386 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.578 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -62.88 -51.45 66.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.249 -178.966 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.631 ' CE1' HG11 ' A' ' 19' ' ' VAL . 22.1 m-85 -70.2 -19.64 63.16 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.895 179.282 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.574 HG22 ' N ' ' A' ' 51' ' ' ASN . 1.3 mm -59.63 -66.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.28 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.574 ' N ' HG22 ' A' ' 50' ' ' ILE . 31.3 m120 -66.58 -39.77 88.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.244 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.455 ' HG3' ' CE3' ' A' ' 48' ' ' TRP . 19.9 mmtt -70.02 -57.08 5.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.11 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 49' ' ' PHE . 7.7 ttm180 -98.75 32.49 2.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.634 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.405 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.0 ttp . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 120.964 0.412 . . . . 0.0 110.755 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.696 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.226 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.696 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.6 Cg_endo -53.22 -21.81 18.13 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.538 1.492 . . . . 0.0 110.971 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.785 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -50.97 -22.32 2.21 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.012 179.16 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.455 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -45.3 -58.07 3.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.25 0.547 . . . . 0.0 109.975 179.025 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.16 -36.72 29.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.726 178.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.785 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.88 -50.48 68.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.178 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.924 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -56.46 -48.23 77.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.395 179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 1.003 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -75.22 -26.37 58.88 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.277 179.474 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -55.84 -58.92 5.83 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.49 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -63.4 -32.04 73.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.984 178.627 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 15' ' ' PHE . 44.4 t -57.97 -59.05 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.117 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.464 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 10.6 t80 -69.92 -12.79 61.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.409 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.539 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -83.7 -35.45 24.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.477 179.716 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -60.87 -38.56 86.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.213 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.497 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 9.6 ptmt -165.05 -149.3 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.399 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.497 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.3 mm100 -144.25 -49.07 0.28 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.057 0.456 . . . . 0.0 111.749 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.6 t -77.75 68.72 3.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.651 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.947 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.7 mt -75.51 109.33 8.97 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -93.92 176.76 6.22 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.933 0.397 . . . . 0.0 111.235 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.3 m -45.48 -29.46 1.14 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.502 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.423 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 4.1 mmpt? -79.64 -45.32 19.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.039 0.447 . . . . 0.0 110.558 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.507 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.4 mt-10 -72.41 -35.93 68.5 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.717 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.966 ' O ' HG11 ' A' ' 45' ' ' VAL . 24.1 pttt -62.02 -34.88 77.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.944 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -89.24 -36.35 15.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.403 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.423 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -74.65 -36.46 62.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.789 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.823 HG11 HG13 ' A' ' 19' ' ' VAL . 74.9 t -78.83 -38.09 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.359 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.723 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.4 -32.03 72.8 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.67 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -88.05 -20.66 25.46 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -25.93 13.08 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.027 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.789 ' SG ' HG22 ' A' ' 19' ' ' VAL . 73.2 m -98.7 -27.48 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.46 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.63 26.32 3.41 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.03 -1.081 . . . . 0.0 113.671 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.942 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -114.02 -163.65 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.932 0.366 . . . . 0.0 110.092 179.043 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.89 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -149.91 156.9 38.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.3 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.89 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.9 Cg_exo -49.91 -24.87 11.12 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.647 2.231 . . . . 0.0 112.338 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.1 tp -89.61 -29.4 18.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.571 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.942 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.7 mm-40 -80.48 -58.62 3.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.807 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.966 HG11 ' O ' ' A' ' 31' ' ' LYS . 26.4 m -36.35 -31.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.618 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.557 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.76 -50.68 7.38 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.041 179.904 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.553 HG23 ' N ' ' A' ' 48' ' ' TRP . 25.5 m -75.58 -43.08 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.463 0.649 . . . . 0.0 110.732 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 1.003 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -63.21 -51.26 67.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.821 -179.618 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.947 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.2 m-30 -69.11 -18.04 63.92 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.549 0.214 . . . . 0.0 110.943 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.557 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -64.04 -59.33 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.535 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.503 ' N ' HG22 ' A' ' 50' ' ' ILE . 98.3 m-20 -75.28 -28.64 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.326 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.845 ' HG3' HD22 ' A' ' 16' ' ' LEU . 11.5 mmtp -84.57 -32.64 23.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.343 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -128.53 38.21 4.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.207 -179.608 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 ttm . . . . . 0 C--N 1.33 -0.252 0 CA-C-O 120.85 0.357 . . . . 0.0 110.831 179.748 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.68 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.308 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.68 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.7 Cg_endo -53.75 -22.42 23.1 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.581 1.521 . . . . 0.0 110.995 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.769 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -51.92 -23.69 5.31 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.851 179.162 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.438 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -45.7 -57.66 4.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.29 0.567 . . . . 0.0 110.087 179.108 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.82 -36.07 32.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.592 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.769 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.66 -53.55 39.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.525 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.903 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.5 -46.92 76.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.581 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 1.05 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -77.78 -25.18 48.88 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.354 179.558 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.6 mm-40 -55.64 -56.2 23.15 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.27 -33.96 76.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.947 178.692 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.903 HG23 ' O ' ' A' ' 15' ' ' PHE . 41.9 t -55.18 -59.92 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.059 0.457 . . . . 0.0 109.797 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.49 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 25.1 t80 -71.06 -10.93 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.759 179.104 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.554 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -78.03 -42.35 32.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.073 0.463 . . . . 0.0 110.476 179.868 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.98 -45.3 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.78 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.463 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -153.15 -155.36 0.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.192 179.682 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.428 ' O ' ' CD ' ' A' ' 53' ' ' ARG . 20.2 mm-40 -140.31 -48.01 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.976 0.417 . . . . 0.0 111.456 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -82.29 78.17 8.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.457 -178.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.945 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.6 OUTLIER -80.11 125.46 29.84 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.592 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.87 -177.93 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.735 0.302 . . . . 0.0 110.551 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.421 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 4.3 t -52.79 -26.16 13.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.142 0.496 . . . . 0.0 110.548 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.99 -48.55 14.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.682 179.608 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.9 mm-40 -72.23 -36.51 69.14 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.644 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.979 ' O ' HG11 ' A' ' 45' ' ' VAL . 33.7 pttt -60.3 -35.49 75.71 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.023 0.439 . . . . 0.0 109.889 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.592 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.3 -35.82 66.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.871 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.845 HG11 HG13 ' A' ' 19' ' ' VAL . 90.4 t -79.95 -39.48 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.494 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.713 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -61.13 -31.66 71.36 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -87.48 -21.18 25.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 2.8 pttt -104.63 -26.06 12.48 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.624 -179.125 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.79 ' SG ' HG22 ' A' ' 19' ' ' VAL . 73.2 m -96.4 -27.49 14.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.258 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.79 21.9 4.85 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.71 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 1.006 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.26 -162.3 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.989 0.394 . . . . 0.0 110.22 179.146 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.889 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -153.57 155.41 31.5 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.624 0.249 . . . . 0.0 110.812 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.889 ' HD2' HG22 ' A' ' 41' ' ' THR . 79.0 Cg_exo -48.04 -27.09 8.5 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.593 2.195 . . . . 0.0 112.331 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.476 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 17.0 tp -89.06 -27.82 20.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 1.006 ' HB2' HG22 ' A' ' 40' ' ' ILE . 3.4 mm100 -82.64 -57.51 3.3 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.782 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.979 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.1 m -36.12 -33.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.299 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.523 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -82.79 -53.53 5.82 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.901 179.579 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.623 HG22 ' HA ' ' A' ' 44' ' ' GLN . 19.8 m -69.9 -42.71 79.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 121.395 0.617 . . . . 0.0 110.777 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 1.05 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -64.35 -53.44 48.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.741 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.945 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.4 m-30 -67.76 -14.06 62.63 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.753 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.523 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.8 OUTLIER -67.38 -56.93 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.854 0.359 . . . . 0.0 110.379 179.817 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.485 ' N ' HG22 ' A' ' 50' ' ' ILE . 31.2 m120 -73.26 -30.6 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.047 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.93 ' HG3' HD22 ' A' ' 16' ' ' LEU . 2.3 mmtp -82.47 -42.5 18.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.851 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.49 ' HG3' ' CE1' ' A' ' 20' ' ' PHE . 16.9 ttp85 -116.77 38.43 3.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.411 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.418 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-O 120.815 0.34 . . . . 0.0 111.005 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.859 0.362 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? 61.29 104.7 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.9 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.48 -74.06 0.59 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.47 103.52 0.72 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.908 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -162.49 90.67 1.32 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.837 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.87 -46.55 1.59 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.512 2.141 . . . . 0.0 112.271 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.2 mttm 54.92 31.29 15.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.041 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -116.03 83.1 0.33 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.352 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -146.9 93.42 2.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.857 0.361 . . . . 0.0 110.863 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 64.71 -78.59 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.073 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 52.3 p -164.08 -179.84 6.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.041 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.836 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.3 tt -112.2 168.66 4.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.895 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.646 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -54.31 -177.49 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.879 179.187 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.646 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.54 -22.87 13.46 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.565 1.51 . . . . 0.0 110.916 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.75 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 96.6 mt-30 -49.36 -25.16 2.27 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.929 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.836 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -45.24 -56.08 5.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.228 0.537 . . . . 0.0 109.91 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.69 -36.19 28.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.679 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.75 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.73 -55.79 15.49 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.499 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.977 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.3 -52.4 63.56 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.491 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.72 HD11 ' HB3' ' A' ' 52' ' ' LYS . 1.6 tp -63.88 -34.25 77.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.987 178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -52.38 -65.01 0.63 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.316 179.584 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -60.73 -32.27 71.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.833 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.977 HG23 ' O ' ' A' ' 15' ' ' PHE . 89.1 t -59.03 -67.26 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.466 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 28.8 t80 -60.85 -17.53 50.69 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.981 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.564 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.67 -38.22 54.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.88 0.372 . . . . 0.0 110.68 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -59.27 -38.92 81.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.443 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.473 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -170.16 -147.57 0.06 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.804 179.805 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.8 mm-40 -140.41 -51.96 0.48 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.179 0.514 . . . . 0.0 110.983 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.5 t -77.6 70.88 4.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.332 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.975 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.9 mt -74.08 106.38 5.73 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.411 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 4.0 p30 -87.48 178.19 6.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.824 0.345 . . . . 0.0 111.658 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.4 m -48.07 -29.29 3.43 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.445 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.421 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.7 mmpt? -77.63 -47.5 19.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.52 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 22.6 mt-10 -73.03 -35.73 66.81 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.945 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.967 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.1 pttt -61.45 -33.87 74.46 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.029 0.442 . . . . 0.0 109.908 179.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -90.49 -36.49 14.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.421 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.1 mm-40 -74.67 -35.57 62.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.859 HG11 HG13 ' A' ' 19' ' ' VAL . 81.9 t -78.96 -37.88 20.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.3 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.704 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.81 -30.19 71.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.098 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -87.34 -21.06 25.92 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.46 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.6 OUTLIER -103.51 -28.91 11.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.636 0.255 . . . . 0.0 111.428 -179.504 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.706 ' SG ' HG22 ' A' ' 19' ' ' VAL . 78.9 m -92.71 -27.84 17.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.289 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.92 24.29 4.95 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.377 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.888 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.97 -163.91 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.025 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.874 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.27 156.5 37.29 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.761 0.315 . . . . 0.0 111.148 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.874 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.1 Cg_exo -49.65 -24.9 10.27 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.687 2.258 . . . . 0.0 112.292 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.2 OUTLIER -90.0 -27.71 19.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.608 179.775 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.888 ' HB2' HG22 ' A' ' 40' ' ' ILE . 7.8 mm100 -82.57 -58.27 2.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.843 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.967 HG11 ' O ' ' A' ' 31' ' ' LYS . 24.9 m -36.67 -32.61 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.282 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.532 ' O ' HG12 ' A' ' 50' ' ' ILE . 1.1 ptp85 -82.37 -60.57 2.16 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.76 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.543 HG23 ' N ' ' A' ' 48' ' ' TRP . 17.2 m -67.87 -44.58 85.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.329 0.585 . . . . 0.0 111.33 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.579 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.85 -52.83 63.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.797 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.975 ' CE2' HD12 ' A' ' 26' ' ' LEU . 18.2 m-30 -64.85 -28.0 69.26 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.714 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.8 mm -53.89 -51.67 42.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.66 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -80.13 -30.65 39.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.695 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.72 ' HB3' HD11 ' A' ' 16' ' ' LEU . 14.6 mmtt -94.94 18.78 11.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.103 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 49' ' ' PHE . 3.6 ttm105 -179.84 33.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.077 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.4 ttt -52.92 88.33 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.882 0.373 . . . . 0.0 110.851 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -80.26 -60.57 2.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.942 -179.65 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.15 -69.49 0.86 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.003 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.898 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.782 0.325 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.59 145.84 35.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -79.72 176.68 9.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.806 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -75.92 166.42 23.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.408 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . 1.2 t -175.78 -61.99 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.604 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.408 ' HD3' ' HB3' ' A' ' 1' ' ' SER . 73.1 Cg_endo -75.14 59.85 5.39 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.524 2.15 . . . . 0.0 112.135 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -129.67 105.67 8.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.984 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.33 30.6 58.54 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.731 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -177.38 151.85 0.8 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.833 0.349 . . . . 0.0 110.785 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.8 m -67.71 -80.92 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.77 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.8 m 47.42 -167.04 0.02 OUTLIER 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.107 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.84 HG22 ' HB2' ' A' ' 12' ' ' ALA . 5.1 tt -177.72 167.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.016 0.436 . . . . 0.0 111.07 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.662 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -55.15 -176.68 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.984 179.244 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.662 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.87 -24.45 13.67 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 121.643 1.562 . . . . 0.0 110.964 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.759 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 98.1 mt-30 -47.63 -27.36 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.699 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.84 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -43.38 -55.85 3.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.184 0.516 . . . . 0.0 110.038 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.66 -36.44 28.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.759 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.06 -56.01 15.52 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.643 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.956 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -56.11 -50.71 70.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.562 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.657 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.1 tp -65.5 -31.71 72.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.918 178.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.478 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 4.0 mt-10 -56.33 -56.15 24.68 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.393 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.466 ' HA ' ' HD3' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -70.48 -24.39 62.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.997 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.956 HG23 ' O ' ' A' ' 15' ' ' PHE . 89.5 t -73.08 -64.22 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.01 0.433 . . . . 0.0 110.951 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.582 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 21.4 t80 -61.82 -17.67 57.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.902 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 1.0 OUTLIER -79.53 -38.49 34.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.518 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -59.27 -38.55 80.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.0 ptmt -169.95 -145.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.564 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.582 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 4.8 mm100 -144.59 -50.04 0.27 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.997 0.427 . . . . 0.0 111.412 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -81.82 71.88 8.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.417 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.988 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.5 mt -73.3 108.94 6.46 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.4 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 4.9 p30 -85.03 176.38 8.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.757 0.313 . . . . 0.0 111.06 -179.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.402 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.5 m -45.9 -29.96 1.57 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.417 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.1 mmpt? -77.65 -48.74 16.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.842 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 mt-10 -70.79 -38.82 73.37 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.892 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.974 ' O ' HG11 ' A' ' 45' ' ' VAL . 2.6 pttt -59.58 -34.33 72.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.017 0.436 . . . . 0.0 110.127 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -90.66 -37.42 13.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.633 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -73.51 -34.53 65.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.553 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.835 HG11 HG13 ' A' ' 19' ' ' VAL . 89.5 t -80.74 -38.8 17.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.402 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.693 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.4 -31.13 72.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.916 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -87.58 -19.95 27.11 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.474 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.02 -24.87 12.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.643 0.259 . . . . 0.0 111.551 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.744 ' SG ' HG22 ' A' ' 19' ' ' VAL . 74.0 m -97.5 -26.67 14.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.291 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.87 25.41 4.53 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.407 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.918 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.55 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.085 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.883 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.94 157.15 40.61 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.883 ' HD2' HG22 ' A' ' 41' ' ' THR . 78.4 Cg_exo -50.41 -24.53 12.28 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.663 2.242 . . . . 0.0 112.269 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.3 tp -89.9 -28.13 19.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.731 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.918 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.8 mm-40 -81.5 -57.98 3.23 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.126 0.488 . . . . 0.0 109.823 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.974 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.7 m -36.32 -32.82 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.615 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.506 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -83.78 -57.98 2.99 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.8 179.665 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.54 HG23 ' N ' ' A' ' 48' ' ' TRP . 21.6 m -68.66 -43.55 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 111.218 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.54 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.66 -53.91 47.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.018 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.988 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.1 m-30 -64.36 -28.9 70.01 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.427 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.2 -52.87 26.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.913 0.387 . . . . 0.0 110.599 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -79.0 -30.59 44.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.638 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.657 ' HB3' HD11 ' A' ' 16' ' ' LEU . 49.7 mmtt -93.89 19.19 9.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.924 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 29.2 ttp180 -177.5 31.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.976 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.54 86.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.902 0.382 . . . . 0.0 110.877 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.9 mmp_? -71.13 -43.68 67.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.713 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.3 t -73.99 123.13 23.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.896 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.5 ttpt . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.953 -179.925 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 14.2 tttm . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.887 0.375 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt -132.1 38.64 3.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.983 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -154.18 104.48 2.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.874 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.84 24.92 8.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.08 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 58.97 161.67 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.929 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.96 84.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.598 2.198 . . . . 0.0 112.158 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.6 tttp -170.19 146.88 3.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.852 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -161.95 59.79 0.29 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.374 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.6 mttt -141.46 -58.13 0.48 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.819 0.343 . . . . 0.0 110.931 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 91.5 p -127.65 -175.18 3.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.99 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.62 -69.15 0.83 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.944 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.932 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.3 tt -115.47 165.85 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.164 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.682 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.97 -175.45 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.07 179.419 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.682 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.9 Cg_endo -51.95 -23.29 16.25 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.759 1.639 . . . . 0.0 111.177 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.79 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -51.2 -23.44 3.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.137 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.932 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -47.69 -57.05 6.0 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.2 0.524 . . . . 0.0 109.852 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -80.99 -34.66 32.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.554 178.931 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.79 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.16 -56.47 12.7 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.239 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.989 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.03 -51.16 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.903 179.595 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.567 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.6 tp -68.53 -31.77 71.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.309 178.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.0 mt-10 -52.47 -57.72 8.99 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.318 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -68.77 -35.99 77.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.899 179.647 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.989 HG23 ' O ' ' A' ' 15' ' ' PHE . 86.6 t -58.52 -64.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-O 120.911 0.386 . . . . 0.0 110.137 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.554 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 63.2 t80 -60.72 -16.19 37.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.169 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.67 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -78.9 -39.21 35.57 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 110.805 179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.5 mtp85 -59.54 -40.34 86.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.884 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.509 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -163.33 -147.87 0.12 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.935 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.554 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 6.5 mm100 -139.05 -49.43 0.51 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.436 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -99.19 91.17 4.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.067 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.877 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.8 mt -78.91 136.74 37.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.101 178.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.72 175.8 6.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.243 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.1 m -51.54 -26.12 7.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.467 . . . . 0.0 110.878 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.426 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -80.01 -47.5 14.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.582 179.673 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.497 ' O ' HG23 ' A' ' 34' ' ' VAL . 2.9 mm-40 -71.63 -37.73 70.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.633 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.965 ' O ' HG11 ' A' ' 45' ' ' VAL . 11.9 pttm -60.29 -35.77 76.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.77 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -89.0 -36.17 15.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.701 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.426 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 8.8 mm-40 -75.18 -36.09 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.728 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.832 HG11 HG13 ' A' ' 19' ' ' VAL . 82.1 t -78.24 -39.37 24.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.01 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.716 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.09 -30.41 71.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.98 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -87.58 -20.52 26.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.443 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 20.2 ptmt -105.07 -26.08 12.26 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.466 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 70.8 m -94.79 -28.2 15.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.101 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.09 23.57 4.85 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.309 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.94 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.78 -162.59 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.113 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.837 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -151.8 153.95 32.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.858 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.837 ' HD2' HG22 ' A' ' 41' ' ' THR . 85.7 Cg_exo -47.28 -26.31 5.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.713 2.275 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.481 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 8.8 tp -88.05 -28.56 21.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.658 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.94 ' HB2' HG22 ' A' ' 40' ' ' ILE . 8.7 mm100 -81.74 -58.14 3.13 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.068 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.965 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.3 m -36.27 -33.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.395 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.525 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -82.05 -58.75 2.83 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.792 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.551 HG23 ' N ' ' A' ' 48' ' ' TRP . 24.3 m -67.82 -43.66 86.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.271 0.558 . . . . 0.0 111.278 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.567 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.77 -54.23 45.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.018 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.877 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -63.7 -29.34 70.58 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 120.674 0.273 . . . . 0.0 110.6 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.4 mm -52.28 -56.06 8.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.747 0.308 . . . . 0.0 110.912 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.405 ' N ' HG22 ' A' ' 50' ' ' ILE . 8.2 m-80 -77.76 -31.16 51.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.506 ' HB3' HD11 ' A' ' 16' ' ' LEU . 52.8 mmtt -90.11 11.63 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.133 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' A' ' 49' ' ' PHE . 9.5 ttp180 -170.57 32.35 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.165 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.51 84.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.965 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 53' ' ' ARG . 8.4 mmp_? -69.24 -41.28 77.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.993 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.8 -169.34 1.99 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.139 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.055 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 3.2 tptt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.877 0.37 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.6 36.25 1.68 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.963 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -169.78 -169.15 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.964 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.84 99.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.6 m -127.87 91.39 45.2 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.953 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.21 148.25 68.2 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.514 2.143 . . . . 0.0 112.298 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt 63.35 126.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.992 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.01 -79.37 0.25 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.528 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.9 83.13 7.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.896 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.9 t -150.45 135.36 17.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.87 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.7 t -75.04 145.26 42.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.946 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.854 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.9 tt -66.03 169.33 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.652 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.64 -176.9 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.96 179.261 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.652 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.37 -23.9 14.87 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.684 1.589 . . . . 0.0 110.985 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.753 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 97.1 mt-30 -49.35 -26.62 3.28 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.832 179.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.854 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -44.08 -55.84 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.338 0.59 . . . . 0.0 110.038 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.402 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -81.49 -36.56 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.612 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.753 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.7 -57.53 7.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.581 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.962 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -54.31 -52.02 62.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.005 179.72 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.663 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.0 tp -64.95 -34.58 78.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.581 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.32 -64.12 0.91 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.362 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -62.75 -34.54 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.974 179.699 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.962 HG23 ' O ' ' A' ' 15' ' ' PHE . 74.9 t -58.58 -65.5 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-O 120.816 0.341 . . . . 0.0 110.137 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -61.34 -15.54 36.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.21 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.581 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.94 -36.27 28.19 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 120.899 0.38 . . . . 0.0 111.063 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -58.87 -37.87 77.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.587 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.451 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.0 ptmt -163.19 -138.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.331 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.436 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 19.5 mm-40 -147.9 -46.5 0.16 Allowed 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.516 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.1 t -100.36 82.92 2.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.054 HD12 ' CE2' ' A' ' 49' ' ' PHE . 5.0 mt -74.95 125.04 28.04 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 176.31 6.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.749 0.309 . . . . 0.0 110.951 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.41 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 37.1 t -45.88 -29.82 1.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.142 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.0 mmpt? -78.19 -48.06 16.7 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.515 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.494 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.7 mt-10 -70.1 -40.15 75.11 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.976 ' O ' HG11 ' A' ' 45' ' ' VAL . 7.3 pttt -58.76 -34.63 71.62 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.16 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.08 -37.01 14.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.678 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -73.88 -34.71 64.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.583 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.821 HG11 HG13 ' A' ' 19' ' ' VAL . 82.4 t -80.29 -38.07 17.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.327 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.682 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.31 -30.9 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.935 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -87.61 -19.22 28.08 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -25.27 13.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 0.0 111.574 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.721 ' SG ' HG22 ' A' ' 19' ' ' VAL . 56.9 m -96.99 -30.22 13.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.064 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.04 22.58 4.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.208 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.917 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -107.05 -163.26 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.87 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -149.98 155.54 37.81 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.674 0.273 . . . . 0.0 111.081 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.87 ' HD2' HG22 ' A' ' 41' ' ' THR . 73.5 Cg_exo -48.79 -29.41 14.77 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.499 2.133 . . . . 0.0 112.037 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.707 HD12 ' HD2' ' A' ' 46' ' ' ARG . 22.5 tp -84.32 -26.93 28.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.683 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.917 ' HB2' HG22 ' A' ' 40' ' ' ILE . 3.5 mm100 -83.35 -59.19 2.54 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.976 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.6 m -36.25 -33.89 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.112 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.791 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -80.68 -58.77 2.95 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.934 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.791 HG13 ' HD3' ' A' ' 46' ' ' ARG . 21.9 m -69.0 -44.28 81.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.361 0.6 . . . . 0.0 111.344 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.565 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.45 -52.8 63.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.023 -179.424 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 1.054 ' CE2' HD12 ' A' ' 26' ' ' LEU . 21.6 m-30 -66.79 -24.76 66.23 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.715 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -55.51 -53.95 30.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.872 0.368 . . . . 0.0 110.369 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -80.83 -30.09 35.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.626 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.663 ' HB3' HD11 ' A' ' 16' ' ' LEU . 63.3 mmtt -93.23 14.94 16.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.021 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.551 ' O ' ' N ' ' A' ' 55' ' ' ARG . 6.5 ttp180 -178.14 36.37 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.167 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.87 69.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.051 0.453 . . . . 0.0 110.299 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.4 OUTLIER -72.47 -54.07 10.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.061 -179.498 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -84.21 171.19 12.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.947 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.843 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 14.0 tptt . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.748 0.309 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 13.4 mttt 63.5 -78.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.06 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 55.41 34.5 23.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.998 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -108.95 59.82 0.6 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.819 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.434 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -61.81 -61.82 7.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.12 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 1' ' ' SER . 27.2 Cg_endo -62.23 168.03 10.02 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.263 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt 61.99 36.38 15.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.865 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.02 -159.35 28.06 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.41 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -147.85 106.52 3.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.803 0.335 . . . . 0.0 110.862 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -117.34 -2.68 11.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.335 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t 61.83 161.83 0.07 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.844 0.354 . . . . 0.0 110.968 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.816 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.2 tt -119.06 168.73 10.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.926 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.66 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.21 -176.74 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.973 179.167 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.66 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.1 Cg_endo -51.73 -23.08 14.72 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.678 1.585 . . . . 0.0 110.999 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.77 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 96.8 mt-30 -49.85 -25.31 3.03 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.865 179.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.816 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -44.4 -56.23 4.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.313 0.578 . . . . 0.0 109.877 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 2.6 ptt85 -81.37 -37.64 27.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.564 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.77 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.57 -56.83 12.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.926 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -54.03 -51.45 63.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.033 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.666 HD11 ' HB3' ' A' ' 52' ' ' LYS . 1.8 tp -64.46 -34.18 77.61 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.572 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.4 -67.08 0.28 Allowed 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.148 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -35.69 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.073 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.926 HG23 ' O ' ' A' ' 15' ' ' PHE . 71.8 t -56.14 -67.73 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.932 0.396 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.552 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 46.7 t80 -61.26 -15.93 40.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.372 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.07 -37.75 28.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.861 0.363 . . . . 0.0 111.005 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.9 mtp-105 -59.99 -37.52 79.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.637 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.451 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.48 -150.35 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.318 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.552 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 7.2 mm100 -141.68 -46.48 0.36 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.987 0.423 . . . . 0.0 111.489 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.1 t -84.55 77.85 9.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.244 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.987 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.0 mt -80.67 109.86 15.62 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -97.49 -176.12 3.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.301 . . . . 0.0 111.317 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.5 m -48.55 -30.9 5.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.42 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.4 mmpt? -77.0 -48.49 17.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.685 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.0 mm-40 -70.69 -39.15 73.66 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.984 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.974 ' O ' HG11 ' A' ' 45' ' ' VAL . 34.6 pttt -58.44 -34.44 70.83 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.089 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -91.82 -36.69 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.736 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.428 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -74.21 -35.38 63.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.646 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.847 HG11 HG13 ' A' ' 19' ' ' VAL . 91.0 t -79.97 -39.86 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.654 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.75 -30.04 71.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.099 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.41 -19.82 27.54 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.45 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -106.69 -21.74 12.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.632 0.253 . . . . 0.0 111.518 -179.467 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.743 ' SG ' HG22 ' A' ' 19' ' ' VAL . 71.6 m -99.31 -26.62 14.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.259 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.57 26.25 4.58 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.329 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.911 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.57 -167.92 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.262 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.855 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -143.04 155.68 62.11 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 111.076 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.855 ' HD2' HG22 ' A' ' 41' ' ' THR . 77.8 Cg_exo -50.26 -25.13 12.81 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.616 2.211 . . . . 0.0 112.28 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.559 ' O ' HD12 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -89.22 -26.28 21.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.626 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.911 ' HB2' HG22 ' A' ' 40' ' ' ILE . 4.5 mm100 -82.26 -58.83 2.77 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.974 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.3 m -36.62 -33.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.404 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.54 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -81.43 -59.48 2.61 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.681 179.576 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.556 HG23 ' N ' ' A' ' 48' ' ' TRP . 20.4 m -69.21 -44.32 80.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.285 0.565 . . . . 0.0 111.379 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.556 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.43 -51.99 66.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.065 -179.447 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.987 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.7 m-30 -67.05 -27.3 67.28 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.674 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.44 -53.88 21.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.584 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -79.92 -29.52 39.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.666 ' HB3' HD11 ' A' ' 16' ' ' LEU . 63.5 mmtt -93.57 17.41 11.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 49' ' ' PHE . 22.7 ttp180 -178.18 32.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.193 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.4 ttm -51.23 89.17 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.931 0.396 . . . . 0.0 111.069 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 53' ' ' ARG . 8.6 mmt180 -72.4 -50.79 23.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.823 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.53 -71.19 0.35 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.78 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.4 tttm . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.868 179.955 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.829 0.347 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.0 58.97 5.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.898 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -105.33 -35.9 7.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.908 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -97.92 38.67 1.28 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.885 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.3 p -98.3 122.4 54.04 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.812 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.45 -53.04 7.26 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.422 2.081 . . . . 0.0 112.314 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.11 -76.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.6 -115.99 5.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.445 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -60.28 123.71 18.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.803 0.335 . . . . 0.0 110.874 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.2 t -98.18 125.36 43.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.01 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.6 t -166.66 96.62 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.622 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.667 HG22 ' HB2' ' A' ' 12' ' ' ALA . 4.4 tt -94.83 169.75 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.427 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.684 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -60.45 -174.77 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.485 179.203 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.684 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.9 Cg_endo -49.8 -24.04 9.47 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.692 1.595 . . . . 0.0 110.998 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.774 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 93.5 mt-30 -46.46 -27.62 1.14 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.91 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.667 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -43.25 -57.06 3.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 110.074 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.413 ' O ' ' N ' ' A' ' 17' ' ' GLU . 1.2 ptm180 -81.13 -35.43 31.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.771 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.774 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.8 -56.59 11.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 120.985 0.421 . . . . 0.0 111.145 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.985 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -52.63 -50.09 63.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.879 179.353 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.619 HD22 ' CG ' ' A' ' 52' ' ' LYS . 0.5 OUTLIER -67.93 -36.21 79.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.801 178.825 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.625 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.7 mt-10 -48.21 -60.54 2.56 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.157 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -65.11 -35.01 79.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.264 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.985 HG23 ' O ' ' A' ' 15' ' ' PHE . 87.8 t -58.12 -65.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 110.035 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.578 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 19.3 t80 -60.72 -17.83 50.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.949 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.625 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.8 -38.87 53.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.952 0.405 . . . . 0.0 110.84 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.38 -41.79 90.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.644 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -164.23 -144.59 0.08 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.631 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.578 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 4.7 mm100 -145.45 -48.47 0.23 Allowed 'General case' 0 C--N 1.334 -0.081 0 CA-C-O 120.881 0.372 . . . . 0.0 111.563 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.3 t -86.01 73.36 10.31 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.999 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.3 mt -73.16 113.45 10.23 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 6.5 p30 -88.2 178.13 6.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.736 0.303 . . . . 0.0 110.99 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -47.44 -28.68 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.001 0.429 . . . . 0.0 111.045 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.0 OUTLIER -77.1 -50.62 12.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.914 179.883 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.5 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 8.7 mt-10 -70.56 -38.9 74.19 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.82 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.992 ' O ' HG11 ' A' ' 45' ' ' VAL . 19.7 pttt -59.05 -34.89 72.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.151 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -90.5 -37.6 13.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.699 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.04 -34.28 66.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.633 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.842 HG11 HG13 ' A' ' 19' ' ' VAL . 92.7 t -81.75 -38.66 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.629 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.707 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.73 -33.72 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.992 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.8 pttm -87.58 -18.83 28.81 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -25.67 13.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.667 0.27 . . . . 0.0 111.44 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.746 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.8 m -98.51 -29.57 13.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.138 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.28 22.96 3.97 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.415 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.899 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.08 -163.77 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 179.12 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.848 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.98 154.45 39.69 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.788 0.328 . . . . 0.0 110.984 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.848 ' HD2' HG22 ' A' ' 41' ' ' THR . 76.3 Cg_exo -47.98 -27.61 9.08 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.61 2.206 . . . . 0.0 112.289 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.454 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.1 tp -85.83 -28.3 24.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.693 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.899 ' HB2' HG22 ' A' ' 40' ' ' ILE . 9.2 mm100 -82.06 -58.84 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.899 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.992 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.9 m -35.94 -33.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.375 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.691 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -82.29 -56.87 3.65 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.05 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.691 HG13 ' HD3' ' A' ' 46' ' ' ARG . 21.5 m -71.55 -43.79 71.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.254 0.55 . . . . 0.0 111.301 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.555 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.61 -55.03 35.09 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.716 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.999 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.5 m-30 -62.71 -22.52 66.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 120.722 0.296 . . . . 0.0 110.443 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -64.48 -52.01 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.166 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -79.82 -34.59 39.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.05 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.619 ' CG ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -80.27 -26.5 38.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.132 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.49 ' O ' ' N ' ' A' ' 55' ' ' ARG . 8.6 ttm180 -133.24 35.39 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.718 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 4.3 ttm -54.84 84.79 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.744 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -73.15 -46.55 50.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.94 -179.563 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.61 -170.75 3.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.945 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.1 mttm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.889 -179.993 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 2.3 pttt . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.757 0.313 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -93.31 125.22 37.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -88.94 5.75 42.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.394 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 4.3 mttp 63.22 135.33 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.824 0.345 . . . . 0.0 110.936 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.412 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 2.1 t -61.51 -60.86 9.15 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.899 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 1' ' ' SER . 55.9 Cg_endo -69.59 139.89 41.93 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.454 2.103 . . . . 0.0 112.315 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -169.25 -45.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.836 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.98 150.94 21.14 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.538 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.1 pttm -107.29 -178.65 3.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.865 0.364 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.5 t 61.36 93.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.904 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 58.67 -175.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.002 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.8 HG22 ' HB2' ' A' ' 12' ' ' ALA . 5.6 tt -134.67 167.85 24.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.993 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.658 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -54.68 -177.02 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.051 179.292 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.658 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.5 Cg_endo -50.52 -24.32 12.27 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.821 1.681 . . . . 0.0 110.876 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.745 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 97.7 mt-30 -48.46 -25.71 1.79 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.87 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.8 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -44.63 -55.27 5.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 0.0 109.935 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -81.93 -37.11 27.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.861 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.745 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.83 -55.08 21.75 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.506 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.964 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.31 -51.88 65.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.014 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.695 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.8 tp -66.05 -33.56 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.638 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.7 mm-40 -51.29 -64.47 0.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -61.34 -36.4 80.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.481 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.964 HG23 ' O ' ' A' ' 15' ' ' PHE . 93.4 t -58.52 -66.85 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.567 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 65.6 t80 -59.51 -18.24 38.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.818 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.638 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -75.39 -39.8 58.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.982 0.42 . . . . 0.0 110.618 179.796 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.515 ' NH1' HG22 ' A' ' 34' ' ' VAL . 49.0 mtp180 -59.52 -40.0 85.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.706 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.5 ptmt -168.89 -144.75 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.427 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.567 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 1.5 mm100 -144.58 -50.25 0.27 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 111.38 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.8 t -85.83 74.39 10.2 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.986 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.9 mt -72.75 129.4 38.11 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.48 -179.65 4.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.753 0.311 . . . . 0.0 110.655 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.405 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 6.0 m -52.21 -26.94 12.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.19 0.519 . . . . 0.0 110.262 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.44 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.14 -50.23 12.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.61 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.494 ' O ' HG23 ' A' ' 34' ' ' VAL . 1.6 mt-10 -70.67 -39.37 73.6 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.815 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.3 pttp -59.0 -34.88 72.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.224 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -90.31 -37.85 13.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.578 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.44 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 5.0 mm-40 -73.13 -35.62 66.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.621 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.822 HG11 HG13 ' A' ' 19' ' ' VAL . 94.3 t -79.63 -38.5 19.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.163 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.694 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.32 -33.42 75.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.336 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -88.22 -19.95 26.17 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.411 ' CG ' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -101.91 -28.84 12.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.62 -179.111 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.741 ' SG ' HG22 ' A' ' 19' ' ' VAL . 71.4 m -95.9 -29.36 14.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.154 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.94 26.88 2.89 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.344 -0.932 . . . . 0.0 113.579 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.878 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -113.1 -161.91 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.053 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.773 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -149.99 151.25 31.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.495 0.188 . . . . 0.0 110.704 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.773 ' HD2' HG22 ' A' ' 41' ' ' THR . 4.7 Cg_endo -47.12 -27.42 6.31 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.83 2.354 . . . . 0.0 112.195 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 10.5 tp -84.81 -28.74 25.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.525 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.878 ' HB2' HG22 ' A' ' 40' ' ' ILE . 38.8 mm-40 -81.74 -58.1 3.15 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.84 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.2 m -36.2 -33.16 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.581 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.529 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -83.31 -55.85 4.09 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.831 179.662 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.552 HG23 ' N ' ' A' ' 48' ' ' TRP . 28.7 m -70.8 -44.03 76.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.344 0.593 . . . . 0.0 111.368 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.695 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.15 -53.24 58.2 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.124 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.986 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -65.48 -27.41 68.48 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.699 0.285 . . . . 0.0 110.601 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -54.59 -55.17 16.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.804 0.335 . . . . 0.0 110.763 -179.775 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.407 ' N ' HG22 ' A' ' 50' ' ' ILE . 49.5 m-80 -79.53 -29.97 41.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.716 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.437 ' HB3' HD11 ' A' ' 16' ' ' LEU . 23.5 mmtt -90.24 10.53 24.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.15 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.522 ' O ' ' N ' ' A' ' 55' ' ' ARG . 12.1 ttp180 -170.38 32.27 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.491 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -51.64 85.77 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.97 0.414 . . . . 0.0 110.76 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.2 mmp_? -76.41 -35.93 58.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.223 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 t -45.25 -54.9 6.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.419 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.9 tttp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.814 179.891 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.898 0.38 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.95 116.97 32.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.968 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 58.96 -171.3 0.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.003 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -78.83 -41.23 30.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.888 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.423 ' CB ' ' HD3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -177.38 -57.14 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.982 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.423 ' HD3' ' CB ' ' A' ' 1' ' ' SER . 84.0 Cg_exo -47.2 125.79 10.81 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.527 2.152 . . . . 0.0 112.445 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.36 78.82 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.707 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.2 133.53 8.01 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.34 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.65 126.19 30.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.818 0.342 . . . . 0.0 111.084 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.8 m -67.61 160.88 26.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.703 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 m -135.29 82.39 1.95 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.076 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.781 HG22 ' HB2' ' A' ' 12' ' ' ALA . 8.4 tt -159.58 165.41 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.973 0.416 . . . . 0.0 111.391 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.686 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.72 -175.48 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.082 179.408 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.686 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.4 Cg_endo -50.87 -24.42 13.58 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.846 1.697 . . . . 0.0 110.965 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.776 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 1.1 mt-30 -49.95 -23.47 2.01 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.031 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.781 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -47.19 -55.8 7.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.143 0.497 . . . . 0.0 109.948 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -81.26 -35.31 31.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.635 178.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.776 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.5 -55.29 18.7 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.168 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 1.006 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.08 -50.84 63.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.841 179.526 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.76 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.2 tp -69.14 -32.24 71.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.655 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -51.47 -56.98 10.33 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.117 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -69.38 -34.31 74.35 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.717 179.417 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 1.006 HG23 ' O ' ' A' ' 15' ' ' PHE . 90.7 t -58.54 -67.03 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.843 0.354 . . . . 0.0 110.046 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.404 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 23.8 t80 -59.1 -16.91 21.86 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.951 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.655 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.91 -40.5 47.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.028 0.442 . . . . 0.0 111.046 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.8 -38.82 79.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.035 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.471 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -166.27 -139.58 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.467 179.649 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.471 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 16.0 mm-40 -148.27 -46.88 0.16 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.917 0.389 . . . . 0.0 111.362 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 53' ' ' ARG . 20.8 t -93.61 78.27 4.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.328 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.06 HD12 ' CE2' ' A' ' 49' ' ' PHE . 4.5 mt -74.13 121.36 21.04 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -90.36 177.02 6.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.745 0.307 . . . . 0.0 110.879 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -48.25 -28.19 2.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.952 0.406 . . . . 0.0 111.071 179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 5.6 mmpt? -78.36 -48.4 15.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.635 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 5.2 mt-10 -70.96 -37.78 72.81 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.884 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.978 ' O ' HG11 ' A' ' 45' ' ' VAL . 35.2 pttt -60.3 -34.82 74.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.038 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -90.06 -37.45 14.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.549 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 9.6 mm-40 -73.47 -35.41 65.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.642 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.847 HG11 HG13 ' A' ' 19' ' ' VAL . 86.3 t -80.09 -37.76 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.295 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.683 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.5 -32.02 73.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.477 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.6 ptmt -87.7 -19.34 27.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.328 -0.396 . . . . 0.0 112.032 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.59 -27.37 12.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.624 0.249 . . . . 0.0 111.492 -179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.742 ' SG ' HG22 ' A' ' 19' ' ' VAL . 77.8 m -96.64 -29.0 14.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.24 24.88 4.0 Favored Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.306 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.85 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.4 -165.43 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.06 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.776 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -146.27 151.77 44.98 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 120.573 0.225 . . . . 0.0 110.624 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.776 ' HD2' HG22 ' A' ' 41' ' ' THR . 4.8 Cg_endo -46.9 -29.1 7.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.745 2.296 . . . . 0.0 112.148 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 31.7 tp -82.42 -29.31 30.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.589 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.85 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.4 mm-40 -81.44 -58.91 2.82 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.897 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.978 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.2 m -35.89 -33.39 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.483 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.565 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.5 OUTLIER -82.56 -56.38 3.9 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.793 179.609 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.565 HG13 ' HD3' ' A' ' 46' ' ' ARG . 27.5 m -69.84 -43.3 79.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.402 0.62 . . . . 0.0 111.117 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.76 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.32 -53.78 50.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.982 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 1.06 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.6 m-30 -66.55 -20.49 66.03 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.657 0.265 . . . . 0.0 110.741 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -59.85 -59.99 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.181 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.488 ' N ' HG22 ' A' ' 50' ' ' ILE . 5.5 p30 -72.94 -43.1 62.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.406 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.506 ' HG3' HD22 ' A' ' 16' ' ' LEU . 43.5 mmtt -71.18 -33.64 70.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.595 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.581 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 2.3 tmt_? -123.13 34.59 5.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.471 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 4.9 ttp -57.21 83.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.916 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.46 ' N ' ' O ' ' A' ' 53' ' ' ARG . 7.8 mmp_? -65.07 -40.11 94.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.646 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.84 160.86 17.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.819 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.962 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.844 0.354 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -2' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 0' ' ' LYS . 2.0 mttt -139.07 -45.59 0.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.018 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 44.67 -91.09 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.534 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 0' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' -2' ' ' LYS . 0.0 OUTLIER -95.48 -179.29 4.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.745 0.307 . . . . 0.0 110.884 179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -178.37 -61.9 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.118 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 1' ' ' SER . 16.1 Cg_endo -57.45 178.25 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.52 2.146 . . . . 0.0 112.342 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.19 94.69 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.929 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -150.8 58.34 0.44 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.529 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -130.44 140.45 50.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.778 0.323 . . . . 0.0 110.926 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 38.5 t 59.67 61.43 1.96 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.3 m -110.11 -25.96 9.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.08 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.688 HG22 ' HB2' ' A' ' 12' ' ' ALA . 11.3 tt -149.58 166.1 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.289 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.686 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -52.17 -175.23 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.453 179.364 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.686 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.7 Cg_endo -50.39 -25.02 13.04 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 121.78 1.654 . . . . 0.0 111.082 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.752 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 3.1 mt-30 -50.79 -23.67 2.91 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.79 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.688 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -47.89 -54.51 12.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.157 0.503 . . . . 0.0 109.814 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -36.52 27.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.723 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.752 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.22 -54.06 35.11 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.574 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.959 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -58.03 -52.5 65.26 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.659 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.5 tp -63.25 -32.58 74.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.81 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.516 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -53.66 -66.59 0.37 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.097 179.332 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.63 -27.42 66.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.959 HG23 ' O ' ' A' ' 15' ' ' PHE . 98.0 t -70.69 -63.28 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.06 0.457 . . . . 0.0 110.731 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.406 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 61.0 t80 -68.42 -11.51 59.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.544 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.516 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -85.73 -36.62 20.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.57 -179.688 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.229 0.538 . . . . 0.0 110.218 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -162.37 -143.1 0.08 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.951 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.406 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 20.1 mm-40 -147.07 -44.82 0.18 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.543 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -101.54 90.39 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.04 HD12 ' CE2' ' A' ' 49' ' ' PHE . 6.7 mt -86.0 130.54 34.51 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.421 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 3.2 p30 -95.48 -176.65 3.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.426 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 11.3 t -52.13 -29.26 21.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.31 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.02 -47.74 17.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.6 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.517 ' O ' HG23 ' A' ' 34' ' ' VAL . 23.9 mt-10 -72.05 -36.99 69.76 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.818 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.966 ' O ' HG11 ' A' ' 45' ' ' VAL . 4.3 pttp -60.89 -34.24 74.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.02 0.438 . . . . 0.0 109.947 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -90.02 -36.39 14.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.534 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -74.94 -35.11 62.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.59 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.815 HG11 HG13 ' A' ' 19' ' ' VAL . 93.3 t -80.12 -36.78 16.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.666 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.84 -29.64 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.503 . . . . 0.0 112.078 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -87.23 -19.92 27.66 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 5.3 ptmm? -103.93 -26.85 12.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.686 0.279 . . . . 0.0 111.513 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 61.2 m -95.21 -27.72 15.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 113.24 24.72 4.68 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.321 -0.943 . . . . 0.0 113.404 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.953 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.55 -165.36 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.163 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.882 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -146.52 158.02 47.43 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 120.769 0.318 . . . . 0.0 111.203 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.882 ' HD2' HG22 ' A' ' 41' ' ' THR . 56.6 Cg_exo -51.61 -23.76 15.79 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.647 2.231 . . . . 0.0 112.374 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.2 tp -91.6 -25.51 19.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.745 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.953 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.4 mm-40 -82.99 -58.54 2.82 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 109.882 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.966 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.7 m -36.53 -33.23 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.218 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.525 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.75 -59.74 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.767 179.563 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.55 HG23 ' N ' ' A' ' 48' ' ' TRP . 20.6 m -68.53 -44.06 83.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.224 0.535 . . . . 0.0 111.38 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.55 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.41 -54.05 48.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.962 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 1.04 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.8 m-30 -64.23 -29.61 70.71 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.458 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -52.84 -51.68 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.908 0.385 . . . . 0.0 110.573 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -79.63 -29.52 41.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.548 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.659 ' HB3' HD11 ' A' ' 16' ' ' LEU . 52.6 mmtt -94.84 18.36 11.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.9 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' PHE . 12.6 ttp180 -176.27 30.63 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.32 88.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.866 0.365 . . . . 0.0 110.99 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.1 mmp_? -69.1 -41.83 76.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.792 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.62 137.78 41.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.906 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.926 179.947 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.881 0.372 . . . . 0.0 111.184 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.83 54.5 3.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.049 0.452 . . . . 0.0 110.809 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -126.41 175.14 8.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.988 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 11.3 tptt 60.54 19.96 9.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.13 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -61.67 0.38 Allowed Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.255 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.21 -44.4 1.79 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.345 2.03 . . . . 0.0 112.424 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -58.28 130.6 47.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.88 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 140.99 -118.49 1.39 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.423 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt 61.91 -163.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.785 0.326 . . . . 0.0 110.905 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 70.67 -79.76 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.906 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 48.83 91.57 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.044 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.757 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.5 tt -59.43 168.67 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.215 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.14 -175.7 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.053 179.146 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.1 Cg_endo -52.92 -22.81 19.28 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 121.589 1.526 . . . . 0.0 111.028 179.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.81 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 95.1 mt-30 -49.76 -26.95 4.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.547 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.757 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -41.66 -59.68 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.249 0.547 . . . . 0.0 110.121 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -81.51 -35.21 30.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.701 178.842 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.81 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.2 -57.73 8.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.234 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.888 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -55.35 -45.06 76.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.504 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.564 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -69.9 -31.69 69.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.911 179.123 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.6 OUTLIER -54.36 -64.61 0.78 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.581 179.049 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -32.33 69.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.304 178.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 15' ' ' PHE . 25.0 t -59.02 -57.24 12.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.991 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.518 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 9.0 t80 -73.41 -11.8 60.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.739 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.13 -37.4 28.91 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.504 179.665 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -60.24 -42.1 94.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.335 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.464 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -160.64 -155.3 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.473 179.746 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.518 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 6.2 mm100 -139.72 -47.99 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 111.551 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 t -77.9 73.77 4.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.455 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.96 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.7 OUTLIER -80.32 115.72 20.01 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.502 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.59 -177.26 3.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.732 0.301 . . . . 0.0 110.626 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.412 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 0.9 OUTLIER -52.1 -26.48 11.26 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.147 0.499 . . . . 0.0 110.604 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.418 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.54 -49.39 13.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.827 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.0 mm-40 -72.29 -36.45 68.97 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.798 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.979 ' O ' HG11 ' A' ' 45' ' ' VAL . 31.7 pttt -60.67 -34.99 75.13 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.077 0.465 . . . . 0.0 109.882 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -90.1 -35.61 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.69 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -75.54 -35.46 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.741 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.827 HG11 HG13 ' A' ' 19' ' ' VAL . 83.4 t -79.46 -39.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.311 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.736 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -60.81 -34.33 74.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.753 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -87.95 -19.11 27.7 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -19.8 13.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.118 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.778 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.9 m -106.34 -27.15 11.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.32 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.3 21.87 4.3 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 120.124 -1.036 . . . . 0.0 114.037 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.929 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.27 -164.77 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.05 0.425 . . . . 0.0 110.166 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.876 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.8 156.98 41.24 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.676 0.275 . . . . 0.0 110.931 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.876 ' HD2' HG22 ' A' ' 41' ' ' THR . 74.1 Cg_exo -49.67 -26.87 13.79 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.62 2.213 . . . . 0.0 112.496 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.4 tp -88.91 -29.01 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 0.0 110.562 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.929 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.8 mm-40 -80.57 -58.23 3.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.77 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.979 HG11 ' O ' ' A' ' 31' ' ' LYS . 22.7 m -35.73 -35.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.508 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.537 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -79.7 -55.39 5.04 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.667 179.526 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.566 HG23 ' N ' ' A' ' 48' ' ' TRP . 29.7 m -69.84 -44.27 79.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.457 0.646 . . . . 0.0 111.202 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.566 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -62.43 -51.49 67.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.211 -179.459 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.96 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.5 m-30 -67.57 -25.73 65.94 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.525 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -56.96 -50.58 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.953 0.406 . . . . 0.0 110.375 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -80.42 -32.23 37.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.523 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -92.95 16.1 13.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.027 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -178.15 35.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.11 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.89 79.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.407 . . . . 0.0 110.654 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.5 mmm180 -80.07 -62.02 1.81 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.815 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.55 -167.96 2.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.86 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.965 179.9 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 6.1 tptm . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.911 0.386 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -163.14 -66.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.949 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -96.48 102.89 14.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.938 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.5 -33.2 74.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.839 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.9 m -77.53 117.92 68.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.844 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.34 -74.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.338 2.025 . . . . 0.0 112.336 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt 57.17 37.63 28.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.934 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -139.59 -161.35 8.69 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.455 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -153.29 124.48 7.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.873 0.368 . . . . 0.0 110.831 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.89 113.68 14.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.918 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -160.53 146.27 14.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.91 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.753 HG22 ' HB2' ' A' ' 12' ' ' ALA . 12.9 tt -176.76 166.9 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.908 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.681 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -50.95 -176.61 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.414 179.282 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -52.09 -23.69 17.93 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.81 1.674 . . . . 0.0 110.952 179.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.807 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 2.9 mp0 -52.12 -24.94 7.73 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.661 179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.753 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -43.99 -59.22 2.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.265 0.555 . . . . 0.0 110.081 179.048 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -82.07 -34.97 29.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.668 178.858 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.807 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.71 -53.91 43.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.011 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.987 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -57.0 -46.97 81.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.34 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.581 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -69.86 -30.03 67.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.264 179.172 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.522 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.9 mt-10 -54.88 -62.8 1.42 Allowed 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.533 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -60.76 -30.97 70.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.986 178.677 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.987 HG23 ' O ' ' A' ' 15' ' ' PHE . 54.4 t -61.76 -61.88 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.423 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 34.4 t80 -65.6 -14.86 62.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.638 178.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.522 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.27 -40.13 52.53 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.97 0.414 . . . . 0.0 110.493 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.654 ' NH1' HG22 ' A' ' 34' ' ' VAL . 37.7 mtp180 -59.12 -42.96 91.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.719 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.48 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -161.48 -145.61 0.11 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.55 179.372 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.12 -50.54 0.43 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.026 0.441 . . . . 0.0 111.589 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -95.29 81.27 3.6 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.943 HD12 ' CE2' ' A' ' 49' ' ' PHE . 4.4 mt -74.5 135.61 42.21 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.9 -178.64 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.416 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 1.3 m -51.13 -27.4 8.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.194 0.521 . . . . 0.0 110.439 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.79 -50.36 11.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.871 179.852 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.513 ' O ' HG23 ' A' ' 34' ' ' VAL . 5.3 mt-10 -71.02 -37.99 72.6 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.046 0.45 . . . . 0.0 109.795 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.967 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.7 pttp -60.5 -34.84 74.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.954 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.53 -35.95 15.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.625 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -75.28 -35.74 61.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.575 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.82 HG11 HG13 ' A' ' 19' ' ' VAL . 85.6 t -78.67 -37.47 20.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.102 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.722 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.47 -30.83 71.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.037 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -87.48 -19.89 27.33 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.1 OUTLIER -105.37 -23.31 12.87 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.499 -179.398 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 64.3 m -98.68 -28.27 13.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.37 21.76 5.06 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.363 -0.922 . . . . 0.0 113.454 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.908 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.14 -163.37 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.894 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.92 157.66 35.41 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.693 0.282 . . . . 0.0 111.104 -179.921 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.894 ' HD2' HG22 ' A' ' 41' ' ' THR . 77.1 Cg_exo -50.27 -25.01 12.63 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.498 2.132 . . . . 0.0 112.249 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.519 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -89.33 -30.28 18.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.588 179.607 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.908 ' HB2' HG22 ' A' ' 40' ' ' ILE . 32.8 mm-40 -80.47 -58.27 3.2 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.856 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.967 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.0 m -34.69 -41.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.841 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -71.56 -60.48 2.21 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.719 179.063 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.572 HG22 ' HA ' ' A' ' 44' ' ' GLN . 15.3 m -63.38 -44.13 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 121.264 0.554 . . . . 0.0 111.259 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.581 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -61.99 -53.64 52.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.957 -179.38 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.943 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.7 m-85 -68.59 -18.72 64.38 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 120.667 0.27 . . . . 0.0 110.858 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -62.39 -55.75 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.846 0.355 . . . . 0.0 110.379 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.449 ' N ' HG22 ' A' ' 50' ' ' ILE . 5.9 m-80 -78.14 -34.07 50.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.217 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.437 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 49.1 mmtt -77.84 -31.88 51.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.133 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.477 ' O ' ' N ' ' A' ' 55' ' ' ARG . 8.1 ttp180 -125.36 31.89 5.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.424 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.5 OUTLIER -49.49 89.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 179.885 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -74.48 -43.32 56.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.79 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -61.96 -44.44 96.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.847 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.915 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.816 0.341 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -121.86 119.98 33.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.21 59.35 0.97 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.83 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -65.43 -64.07 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.785 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.3 p -158.88 143.58 11.57 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.785 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.56 -169.51 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.455 2.103 . . . . 0.0 112.333 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -128.39 87.91 2.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.852 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.88 -53.93 0.73 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.263 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.5 mttt 63.03 -80.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.793 0.33 . . . . 0.0 111.138 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 62.01 -179.71 0.13 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.848 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.3 m -84.24 179.93 7.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.908 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.799 HG22 ' HB2' ' A' ' 12' ' ' ALA . 5.8 tt -113.24 167.76 6.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.005 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.14 -175.78 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.007 179.163 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -53.46 -22.3 20.98 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 121.62 1.547 . . . . 0.0 110.961 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.794 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 94.5 mt-30 -50.09 -26.32 4.34 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.807 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.799 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -41.94 -58.38 2.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.286 0.565 . . . . 0.0 110.125 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -37.67 26.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.779 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.794 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -61.32 -56.08 24.5 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.831 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.96 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.1 -48.86 67.47 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.675 179.143 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.571 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -67.22 -30.06 69.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.201 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -55.78 -65.37 0.61 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.57 179.064 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -59.35 -28.86 67.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.371 178.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.96 HG23 ' O ' ' A' ' 15' ' ' PHE . 42.0 t -62.38 -60.26 3.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.342 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.415 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 26.9 t80 -68.94 -13.02 62.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -83.69 -35.01 24.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.903 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 46.2 mtp85 -59.46 -39.52 83.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.176 0.512 . . . . 0.0 110.313 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.495 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -158.62 -145.5 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.394 179.177 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.457 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.72 -50.6 0.41 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.078 0.466 . . . . 0.0 111.59 -179.032 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.2 t -95.63 81.25 3.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.724 -178.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.914 HD12 ' CE2' ' A' ' 49' ' ' PHE . 3.7 mt -73.42 117.13 14.8 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -93.45 175.69 6.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.647 0.261 . . . . 0.0 110.871 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.5 m -44.66 -29.85 0.82 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.997 0.427 . . . . 0.0 111.131 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.7 mmpt? -78.01 -48.6 15.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.763 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.3 mt-10 -71.14 -37.96 72.26 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.979 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 13.3 pttt -60.74 -34.14 73.98 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.65 -36.58 15.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.406 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.8 mm-40 -74.5 -35.82 63.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.487 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.829 HG11 HG13 ' A' ' 19' ' ' VAL . 75.3 t -78.33 -37.82 22.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.017 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.735 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.15 -31.16 72.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.059 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ptmt -87.47 -19.76 27.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.45 -23.55 12.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.585 0.231 . . . . 0.0 111.571 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.733 ' SG ' HG22 ' A' ' 19' ' ' VAL . 61.0 m -99.78 -25.56 14.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.482 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.23 26.9 4.13 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.304 -0.95 . . . . 0.0 113.582 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.91 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -115.48 -164.22 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.067 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.875 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.38 159.15 35.39 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.31 . . . . 0.0 111.135 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.875 ' HD2' HG22 ' A' ' 41' ' ' THR . 65.9 Cg_exo -51.27 -24.45 15.56 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.527 2.151 . . . . 0.0 112.304 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.826 ' O ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -89.73 -31.28 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.181 179.666 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.91 ' HB2' HG22 ' A' ' 40' ' ' ILE . 26.8 mm-40 -79.63 -58.15 3.33 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.802 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 23.9 m -35.14 -43.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.019 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.481 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -70.29 -59.61 2.77 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.922 179.362 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.563 HG23 ' N ' ' A' ' 48' ' ' TRP . 19.0 m -65.21 -45.22 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 121.235 0.54 . . . . 0.0 111.522 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.571 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.87 -52.74 63.76 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.001 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.914 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.4 m-85 -67.85 -25.39 65.52 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.628 0.252 . . . . 0.0 110.805 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -56.46 -53.92 34.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -79.84 -29.2 40.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.685 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.468 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 15.0 mmtt -93.0 12.64 23.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.173 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 11.6 ttp180 -174.35 34.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ttm -55.81 85.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 110.912 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.3 mmp_? -64.71 -44.45 90.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.862 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.13 -50.89 0.65 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.9 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.829 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.787 0.327 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.24 19.69 13.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.183 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 53.36 88.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.839 0.352 . . . . 0.0 111.057 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 7.5 mtmp? -91.41 136.39 33.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.9 t -136.73 65.21 53.29 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.987 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.97 113.6 1.48 Allowed 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.574 2.183 . . . . 0.0 112.192 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.59 -74.22 0.5 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.891 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.87 174.23 35.92 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.612 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.7 mmtm 62.16 63.85 1.03 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.836 0.35 . . . . 0.0 110.737 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 t 57.76 45.8 18.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.659 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -26.83 46.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.257 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.753 HG22 ' HB2' ' A' ' 12' ' ' ALA . 2.6 tt -97.43 168.19 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.013 0.435 . . . . 0.0 111.282 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.681 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -63.09 -174.98 0.11 Allowed Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.508 179.342 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.2 Cg_endo -50.57 -22.47 9.26 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.553 1.502 . . . . 0.0 111.076 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.738 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 95.1 mt-30 -47.79 -25.62 1.33 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.948 179.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.753 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -45.41 -55.87 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 109.987 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.11 -35.73 31.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.974 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.738 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.46 -54.46 23.84 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.248 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.993 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.32 -49.25 67.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.977 179.532 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.631 HD22 ' CG ' ' A' ' 52' ' ' LYS . 0.4 OUTLIER -71.15 -33.88 70.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.914 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.681 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.3 mm-40 -49.72 -54.82 16.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.172 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -70.21 -33.86 72.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.402 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.993 HG23 ' O ' ' A' ' 15' ' ' PHE . 97.9 t -59.63 -65.42 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -60.75 -18.68 56.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.775 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.681 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.5 OUTLIER -72.61 -41.8 65.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.43 . . . . 0.0 110.358 179.654 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -61.26 -41.33 96.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.506 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -169.07 -156.78 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.24 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -134.56 -51.01 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.99 0.424 . . . . 0.0 111.607 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.6 t -84.12 78.54 9.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.52 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.909 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.8 mt -76.04 134.25 40.14 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.27 178.78 4.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.673 0.273 . . . . 0.0 110.416 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.403 ' HB2' ' HE2' ' A' ' 29' ' ' LYS . 3.4 m -51.23 -27.11 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.215 0.531 . . . . 0.0 110.405 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.11 -51.27 10.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.839 179.87 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.496 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.3 mt-10 -70.53 -39.1 74.24 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.834 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.983 ' O ' HG11 ' A' ' 45' ' ' VAL . 9.5 pttt -59.19 -35.24 73.23 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.72 -37.97 14.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.494 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 11.0 mm-40 -72.9 -35.09 67.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.764 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.829 HG11 HG13 ' A' ' 19' ' ' VAL . 85.0 t -79.81 -39.11 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.317 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.96 -29.85 70.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.125 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -87.31 -21.91 25.45 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 9.8 ptmt -102.72 -30.45 10.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.73 0.3 . . . . 0.0 111.396 -179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.755 ' SG ' HG22 ' A' ' 19' ' ' VAL . 75.7 m -90.42 -29.9 17.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.047 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.33 21.5 5.16 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.355 -0.926 . . . . 0.0 113.408 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.881 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -106.5 -161.96 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.879 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -152.31 155.35 33.03 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 111.119 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.879 ' HD2' HG22 ' A' ' 41' ' ' THR . 71.0 Cg_exo -48.86 -25.91 9.14 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.572 2.181 . . . . 0.0 112.306 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 4.9 tp -87.86 -28.97 21.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.593 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.881 ' HB2' HG22 ' A' ' 40' ' ' ILE . 8.8 mm100 -82.44 -58.53 2.89 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.984 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.983 HG11 ' O ' ' A' ' 31' ' ' LYS . 24.6 m -35.9 -34.09 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.202 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.771 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -81.2 -58.8 2.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.078 179.482 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.771 HG13 ' HD3' ' A' ' 46' ' ' ARG . 20.0 m -70.11 -44.57 78.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.276 0.56 . . . . 0.0 111.448 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.562 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -60.33 -55.68 30.7 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.655 -179.595 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.909 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -61.44 -26.9 68.18 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.488 178.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.9 mm -59.62 -51.83 68.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.329 . . . . 0.0 110.485 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -80.59 -39.39 27.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.215 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.631 ' CG ' HD22 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -75.2 -21.94 58.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.225 -179.785 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 7.2 ttm180 -134.96 30.21 3.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.564 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.415 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.8 ttp -48.39 91.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.88 0.371 . . . . 0.0 111.033 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -73.74 -41.87 61.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.936 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.5 t 38.54 55.03 1.89 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.927 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.18 -0.914 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.846 0.355 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -138.6 140.89 39.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.987 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 59.1 109.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.981 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.92 127.23 30.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.017 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.88 165.53 5.87 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.853 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.54 149.59 84.27 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.565 2.177 . . . . 0.0 112.28 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -126.85 152.67 46.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.844 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.47 144.28 16.13 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.445 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 163.28 3.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.872 0.368 . . . . 0.0 110.866 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 m 70.26 -63.4 0.4 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.076 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 71.95 -65.03 0.37 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.822 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.812 HG22 ' HB2' ' A' ' 12' ' ' ALA . 4.4 tt -154.61 169.08 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.212 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.669 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -56.35 -176.93 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.826 179.102 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.669 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.3 Cg_endo -51.06 -23.97 13.47 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 121.638 1.558 . . . . 0.0 110.895 179.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.792 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 98.0 mt-30 -47.96 -27.27 2.11 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.858 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.812 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -42.92 -57.8 2.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.23 0.538 . . . . 0.0 110.04 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.446 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.86 -34.15 30.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.768 178.886 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.792 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.41 -57.5 7.27 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.998 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -53.13 -47.99 68.26 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.168 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.844 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -67.61 -39.46 84.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.812 178.675 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.639 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.7 mm-40 -45.88 -61.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.338 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -64.61 -34.22 77.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.386 179.169 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.998 HG23 ' O ' ' A' ' 15' ' ' PHE . 54.9 t -57.77 -65.9 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.108 0.48 . . . . 0.0 109.896 178.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.594 ' CZ ' ' NE2' ' A' ' 24' ' ' GLN . 41.3 t80 -62.26 -15.0 44.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.711 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -81.07 -36.92 29.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.921 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.48 -37.24 77.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.074 0.464 . . . . 0.0 110.501 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -167.8 -143.95 0.05 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.494 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.594 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 6.5 mm100 -145.82 -48.75 0.22 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.007 0.432 . . . . 0.0 111.59 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 t -83.24 71.08 10.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.342 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.0 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.7 mt -74.1 110.65 8.56 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.04 179.8 5.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.189 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.407 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 1.9 m -44.92 -30.61 1.04 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.737 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.1 mmpt? -78.25 -48.86 14.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.932 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.6 mt-10 -71.4 -37.92 71.48 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.816 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.939 ' O ' HG11 ' A' ' 45' ' ' VAL . 32.3 pttt -59.66 -34.97 73.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.049 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -90.18 -37.21 14.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.574 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.1 mm-40 -73.57 -35.3 65.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.639 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.85 HG11 HG13 ' A' ' 19' ' ' VAL . 75.8 t -79.01 -40.71 22.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.36 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.688 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -61.05 -31.25 70.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.006 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -87.63 -19.45 27.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.457 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -105.5 -23.42 12.81 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.543 -179.403 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.75 ' SG ' HG22 ' A' ' 19' ' ' VAL . 60.8 m -99.42 -28.39 13.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.274 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.55 20.39 5.45 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.709 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.889 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -106.61 -167.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 178.987 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.858 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -144.19 155.53 58.15 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.293 . . . . 0.0 111.119 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.858 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.6 Cg_exo -49.41 -25.92 11.1 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.702 2.268 . . . . 0.0 112.524 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.51 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -89.01 -27.1 21.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.08 0.467 . . . . 0.0 110.784 179.78 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.889 ' HB2' HG22 ' A' ' 40' ' ' ILE . 38.6 mm-40 -81.89 -58.96 2.75 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.817 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.939 HG11 ' O ' ' A' ' 31' ' ' LYS . 25.6 m -36.7 -34.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.186 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.7 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -78.71 -62.75 1.59 Allowed 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.031 179.577 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.7 HG13 ' HD3' ' A' ' 46' ' ' ARG . 11.1 m -70.27 -46.9 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 111.67 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.844 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.57 -48.41 77.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.612 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 1.0 ' CE2' HD12 ' A' ' 26' ' ' LEU . 15.9 m-30 -65.62 -31.86 73.13 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.905 179.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.695 HG12 ' O ' ' A' ' 46' ' ' ARG . 2.7 mm -49.75 -52.34 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.97 0.414 . . . . 0.0 110.566 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.37 -33.67 48.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.145 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.472 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 22.9 mmtt -95.54 22.87 6.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.168 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 55' ' ' ARG . 5.3 ttp180 -178.9 29.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.315 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -52.29 84.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.526 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.9 mmp_? -71.4 -49.41 42.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.078 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -136.03 173.93 11.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.4 mttp . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.868 179.986 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.765 0.317 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 60.05 -174.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.882 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -83.5 127.72 33.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.867 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.47 120.44 3.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.418 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.4 OUTLIER -74.37 -52.29 4.05 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.982 -179.974 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 1' ' ' SER . 52.4 Cg_exo -54.76 147.81 48.6 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.445 2.097 . . . . 0.0 112.199 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.8 -36.64 31.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.872 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.22 -22.98 3.36 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.749 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.2 tttt 59.88 65.92 1.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.904 0.383 . . . . 0.0 110.683 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 72.4 p -58.1 -38.85 77.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.054 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.3 t -84.62 70.11 10.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.869 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.978 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.0 tt -87.86 166.58 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.068 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.671 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.01 -176.51 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.01 179.14 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.671 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 12.4 Cg_endo -54.52 -20.85 22.16 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 121.658 1.572 . . . . 0.0 110.945 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.759 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 2.8 mp0 -53.18 -23.22 7.87 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.891 179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.978 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -46.06 -58.28 3.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.274 0.559 . . . . 0.0 110.114 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.78 -35.65 32.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.702 179.02 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.759 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.51 -51.12 62.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.405 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.913 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -56.5 -48.06 77.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.372 179.936 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.966 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -75.39 -27.34 59.05 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.177 179.344 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.523 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.1 mt-10 -54.25 -59.46 4.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -62.65 -32.16 73.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.989 178.751 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.913 HG23 ' O ' ' A' ' 15' ' ' PHE . 55.8 t -60.27 -59.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.411 179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.428 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 18.5 t80 -68.52 -14.01 62.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.901 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.64 -36.17 26.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.857 0.36 . . . . 0.0 110.558 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -60.84 -37.92 83.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.57 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.488 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 1.1 ptmm? -164.44 -147.91 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.372 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.488 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 27.6 mm-40 -146.34 -48.53 0.2 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.903 0.382 . . . . 0.0 111.675 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.3 t -83.18 73.64 10.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.983 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.0 OUTLIER -74.65 117.0 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.99 177.09 6.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.875 0.369 . . . . 0.0 110.934 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.402 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 2.4 m -47.93 -29.14 3.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.161 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 3.4 mmpt? -78.23 -48.55 15.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.793 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.513 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.2 mt-10 -71.75 -36.83 70.55 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.946 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.976 ' O ' HG11 ' A' ' 45' ' ' VAL . 16.1 pttt -61.54 -34.55 75.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.001 0.429 . . . . 0.0 110.057 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -89.83 -36.44 15.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.505 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 7.3 mm-40 -74.72 -35.53 62.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.683 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.799 HG11 HG13 ' A' ' 19' ' ' VAL . 79.6 t -79.16 -38.92 20.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.245 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.714 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.1 -31.68 72.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.95 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -87.71 -20.21 26.55 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.486 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 1.4 pttp -105.35 -24.19 12.71 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.529 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.751 ' SG ' HG22 ' A' ' 19' ' ' VAL . 77.0 m -98.15 -27.77 14.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.228 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.77 23.85 4.19 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.16 -1.019 . . . . 0.0 113.702 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.886 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.01 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.953 0.376 . . . . 0.0 110.117 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.885 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -147.67 157.11 44.8 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.775 0.321 . . . . 0.0 111.003 179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.885 ' HD2' HG22 ' A' ' 41' ' ' THR . 65.1 Cg_exo -51.19 -23.99 14.2 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.58 2.187 . . . . 0.0 112.3 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -91.38 -28.3 17.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.1 0.476 . . . . 0.0 110.757 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.886 ' HB2' HG22 ' A' ' 40' ' ' ILE . 3.9 mm100 -80.97 -57.0 3.73 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.976 HG11 ' O ' ' A' ' 31' ' ' LYS . 18.6 m -36.23 -36.4 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.117 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -78.14 -57.57 3.72 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.834 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.569 HG23 ' N ' ' A' ' 48' ' ' TRP . 21.0 m -68.27 -44.87 83.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.214 0.531 . . . . 0.0 111.451 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.966 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.05 -53.2 60.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.958 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.983 ' CE2' HD12 ' A' ' 26' ' ' LEU . 23.0 m-30 -66.46 -28.9 68.95 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.672 0.272 . . . . 0.0 110.521 179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -54.93 -52.74 40.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.861 0.362 . . . . 0.0 110.562 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -78.01 -29.07 49.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.159 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.765 ' HG3' HD22 ' A' ' 16' ' ' LEU . 35.5 mmtt -94.87 19.0 10.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.791 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 55' ' ' ARG . 11.1 ttp-105 -178.34 33.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.061 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 ttm -58.71 76.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.01 0.433 . . . . 0.0 110.72 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 53' ' ' ARG . 28.4 mmm-85 -62.26 -38.57 89.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.117 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.32 -55.44 1.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.322 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.153 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 3.3 pttp . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 120.758 0.313 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 14.2 mmmt -108.08 -28.38 9.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.026 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -139.72 149.22 43.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.882 0.372 . . . . 0.0 111.015 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -82.84 168.32 17.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.727 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.437 ' CB ' ' HD3' ' A' ' 2' ' ' PRO . 0.4 OUTLIER -66.23 -51.73 42.63 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.884 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.437 ' HD3' ' CB ' ' A' ' 1' ' ' SER . 9.9 Cg_exo -71.75 60.4 2.86 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.747 2.298 . . . . 0.0 112.192 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 16.7 mttt 67.37 -70.37 0.12 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.061 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.63 94.37 0.1 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.523 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -159.97 -49.7 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.798 0.332 . . . . 0.0 110.743 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 t 60.87 111.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.979 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.6 t -69.72 135.33 49.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.734 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.764 HG22 ' HB2' ' A' ' 12' ' ' ALA . 9.6 tt -98.55 165.39 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.99 0.424 . . . . 0.0 111.386 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.696 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.99 -175.58 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.137 179.329 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.696 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.3 Cg_endo -50.85 -23.93 12.61 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.904 1.736 . . . . 0.0 110.949 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.79 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -50.34 -22.77 1.96 Allowed 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.083 179.047 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.764 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -48.12 -56.88 6.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.298 0.571 . . . . 0.0 109.747 178.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.425 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -81.22 -34.41 32.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.712 179.039 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.79 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.54 -48.41 69.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.411 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.969 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -58.81 -45.1 90.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.889 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.837 HD21 ' HB3' ' A' ' 52' ' ' LYS . 24.1 tp -76.13 -30.78 58.33 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.926 178.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.575 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 2.5 mt-10 -52.23 -43.45 64.31 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.83 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -81.77 -28.21 33.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.584 179.242 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.969 HG23 ' O ' ' A' ' 15' ' ' PHE . 86.6 t -67.2 -64.02 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.876 0.37 . . . . 0.0 110.388 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.457 ' CE2' ' HG3' ' A' ' 53' ' ' ARG . 11.0 t80 -60.4 -26.47 66.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.772 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -77.43 -42.63 35.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.498 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.6 mtp85 -59.74 -40.13 87.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.499 . . . . 0.0 110.194 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.479 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.22 -160.35 0.54 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.519 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.428 ' NE2' ' CZ ' ' A' ' 20' ' ' PHE . 4.6 mm100 -141.99 -46.63 0.35 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.207 0.527 . . . . 0.0 111.526 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.9 t -74.99 71.38 2.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.158 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.759 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -76.78 109.51 10.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.958 178.864 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 -179.15 4.65 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.403 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 9.6 t -50.74 -28.43 9.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.187 0.517 . . . . 0.0 110.347 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.445 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.01 -50.91 11.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.958 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.499 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.0 mm-40 -70.89 -38.41 73.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.032 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.991 ' O ' HG11 ' A' ' 45' ' ' VAL . 6.4 pttp -60.23 -34.68 74.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.025 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.81 -37.19 13.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.584 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.5 mm-40 -73.8 -37.34 64.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.872 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.818 HG11 HG13 ' A' ' 19' ' ' VAL . 93.3 t -78.18 -40.0 25.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.299 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.703 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -60.95 -31.74 71.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.443 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -88.06 -19.9 26.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.422 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -103.34 -25.73 13.19 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.646 -179.35 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.73 ' SG ' HG22 ' A' ' 19' ' ' VAL . 70.9 m -98.27 -28.71 13.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.139 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.73 20.69 4.89 Favored Glycine 0 C--N 1.33 0.21 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.504 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.944 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -105.77 -163.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.887 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.49 157.2 42.01 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.692 0.282 . . . . 0.0 111.074 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.887 ' HD2' HG22 ' A' ' 41' ' ' THR . 63.2 Cg_exo -51.52 -23.8 15.43 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.599 2.199 . . . . 0.0 112.281 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.493 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -90.7 -27.23 19.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.056 0.455 . . . . 0.0 110.694 179.693 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.944 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.7 mm-40 -81.5 -59.5 2.6 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.829 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.991 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.5 m -35.82 -32.96 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.445 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.512 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.77 -59.94 2.42 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.6 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.555 HG23 ' N ' ' A' ' 48' ' ' TRP . 19.9 m -67.95 -43.86 85.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.359 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.555 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.0 -54.08 46.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.042 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.759 ' CE2' HD12 ' A' ' 26' ' ' LEU . 21.6 m-30 -65.88 -24.61 66.89 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.704 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -55.49 -58.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.677 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.456 ' N ' HG22 ' A' ' 50' ' ' ILE . 73.5 m-20 -79.17 -32.4 44.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.051 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.837 ' HB3' HD21 ' A' ' 16' ' ' LEU . 13.6 mmtt -85.15 1.02 49.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.539 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -164.93 37.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.971 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.3 ttp -62.25 73.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.976 0.417 . . . . 0.0 110.822 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' A' ' 53' ' ' ARG . 44.7 mmm-85 -68.55 -43.18 77.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.778 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.5 t -55.81 132.67 49.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.03 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.866 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 9.8 mmmt . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.814 0.34 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -39.94 87.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.892 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -175.8 -69.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.94 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 2.9 mtpm? -98.89 175.63 5.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.941 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.4 t 60.37 63.66 2.83 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.903 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.4 -35.22 53.78 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.56 2.173 . . . . 0.0 112.4 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -149.47 166.42 29.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.002 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.02 166.27 29.75 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.458 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.4 ' O ' ' N ' ' A' ' 7' ' ' SER . 7.8 mmtt 60.82 84.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.8 0.333 . . . . 0.0 110.799 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.53 -82.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.989 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 5' ' ' LYS . 0.4 OUTLIER 171.14 -70.91 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.827 0.346 . . . . 0.0 110.901 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.731 HG22 ' HB2' ' A' ' 12' ' ' ALA . 8.5 tt -93.24 169.39 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.064 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.669 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.92 -175.67 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.02 179.293 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.669 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.55 -24.25 12.24 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.607 1.538 . . . . 0.0 111.087 179.22 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.727 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 96.7 mt-30 -48.83 -26.85 2.63 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.579 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.731 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -44.95 -55.05 5.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.219 0.533 . . . . 0.0 110.025 179.33 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.54 -36.34 29.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.678 178.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.727 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.51 -57.44 7.31 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.515 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.972 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.73 -49.09 68.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.93 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.741 HD13 ' CE3' ' A' ' 48' ' ' TRP . 2.2 tp -68.91 -34.15 74.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.098 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -49.97 -59.53 3.79 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.159 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.31 -37.1 84.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.758 179.476 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.972 HG23 ' O ' ' A' ' 15' ' ' PHE . 93.0 t -56.12 -68.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.831 0.348 . . . . 0.0 110.085 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -16.29 15.92 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.989 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.67 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -80.0 -37.96 33.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.745 0.307 . . . . 0.0 111.223 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 -59.06 -37.33 76.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.468 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.2 ptmt -167.15 -145.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.537 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.439 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -140.68 -50.25 0.45 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.928 0.395 . . . . 0.0 111.716 -179.131 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.6 78.57 4.31 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.049 HD12 ' CE2' ' A' ' 49' ' ' PHE . 5.1 mt -72.3 124.71 25.65 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -98.01 176.89 5.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.756 0.312 . . . . 0.0 111.145 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.426 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 12.0 t -44.69 -31.17 1.09 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.8 mmpt? -78.66 -47.22 17.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.914 0.388 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.503 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.2 mt-10 -70.69 -38.34 73.68 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.81 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 7.1 pttt -59.95 -34.98 73.99 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -89.72 -37.38 14.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.545 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -73.05 -35.73 66.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.555 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.835 HG11 HG13 ' A' ' 19' ' ' VAL . 80.1 t -79.48 -38.16 19.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.252 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.6 -31.87 73.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.441 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -87.82 -19.6 27.24 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -26.2 13.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.661 0.267 . . . . 0.0 111.566 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.725 ' SG ' HG22 ' A' ' 19' ' ' VAL . 86.2 m -97.6 -28.44 13.94 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.299 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.42 23.33 4.48 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.35 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.877 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.8 -163.89 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.086 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.771 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.0 OUTLIER -149.18 153.02 37.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.591 0.234 . . . . 0.0 110.809 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.771 ' HD2' HG22 ' A' ' 41' ' ' THR . 5.0 Cg_endo -47.38 -26.97 6.47 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.827 2.351 . . . . 0.0 112.239 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.475 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.6 OUTLIER -84.1 -30.33 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.588 179.641 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.877 ' HB2' HG22 ' A' ' 40' ' ' ILE . 3.2 mm100 -81.77 -57.55 3.39 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.779 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 22.8 m -36.69 -32.75 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.422 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.751 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.5 OUTLIER -83.32 -56.5 3.73 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.886 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.751 HG13 ' HD3' ' A' ' 46' ' ' ARG . 28.2 m -69.8 -42.82 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.376 0.608 . . . . 0.0 111.178 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.741 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -63.33 -55.86 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.829 -179.53 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 1.049 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.1 m-30 -64.15 -18.87 64.87 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-O 120.682 0.277 . . . . 0.0 110.588 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -64.45 -55.36 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.893 0.377 . . . . 0.0 110.388 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.404 ' N ' HG22 ' A' ' 50' ' ' ILE . 21.4 m-80 -77.72 -34.9 52.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.916 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.562 ' HG3' HD22 ' A' ' 16' ' ' LEU . 15.2 mmtt -81.47 -19.56 42.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.132 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 55' ' ' ARG . 8.9 ttm180 -145.04 44.03 1.33 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.741 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.49 68.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.996 0.427 . . . . 0.0 110.48 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 53' ' ' ARG . 5.9 mmp_? -73.57 -57.81 3.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.962 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t 36.4 -89.34 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.365 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.815 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.911 0.386 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm 60.33 33.92 20.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.957 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -158.92 -72.05 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.967 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm 60.65 104.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.83 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.414 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -178.88 -61.24 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.11 -179.998 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 1' ' ' SER . 46.2 Cg_endo -67.71 -165.69 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.429 2.086 . . . . 0.0 112.295 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 68.53 90.45 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.936 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 73.7 155.8 3.81 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.742 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.57 157.24 47.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.823 0.344 . . . . 0.0 110.875 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.8 p 58.03 46.19 16.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.878 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.1 t -62.93 165.52 6.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.829 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.726 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.3 tt -62.23 166.68 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.087 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.678 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.42 -176.48 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.105 179.271 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.678 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.7 Cg_endo -50.75 -24.38 13.13 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.936 1.757 . . . . 0.0 111.02 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.879 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 4.2 mt-30 -49.98 -26.33 4.15 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.837 179.091 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.726 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -41.7 -59.76 1.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.303 0.573 . . . . 0.0 110.058 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.438 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.32 -33.93 28.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.517 178.674 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.879 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.69 -58.19 6.96 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.344 -179.243 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.884 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -57.73 -45.15 86.19 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.578 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -67.59 -36.17 80.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.022 0.439 . . . . 0.0 109.963 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.8 mt-10 -50.03 -66.4 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.701 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -58.69 -34.78 71.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 15' ' ' PHE . 34.4 t -58.31 -59.08 4.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.0 0.428 . . . . 0.0 110.243 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.449 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 5.1 t80 -69.75 -12.92 62.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.144 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -84.82 -37.39 20.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.858 0.361 . . . . 0.0 110.955 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.42 -37.11 84.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.652 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.614 ' HD2' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -160.01 -164.76 1.35 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.546 179.851 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 20' ' ' PHE . 40.8 mm-40 -137.78 -20.88 1.13 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.227 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.8 t -102.89 74.33 1.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.612 HD21 ' HD3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -71.5 97.57 1.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.324 178.754 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.457 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -88.46 172.17 9.56 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.257 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.9 t -44.53 -31.21 1.04 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.1 mmpt? -78.18 -49.75 13.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.833 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 34' ' ' VAL . 1.9 mm-40 -68.94 -41.82 77.57 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.913 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.97 ' O ' HG11 ' A' ' 45' ' ' VAL . 6.9 pttp -57.52 -35.48 70.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.29 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.403 ' HG3' ' N ' ' A' ' 33' ' ' GLU . 7.6 pt-20 -89.04 -37.57 15.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.58 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.432 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.2 mm-40 -73.48 -35.52 65.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.602 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.803 HG11 HG13 ' A' ' 19' ' ' VAL . 81.2 t -79.42 -38.41 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.298 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.713 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.45 -35.09 78.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.456 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.12 -19.69 26.66 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.094 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -102.58 -25.47 13.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.061 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.773 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.5 m -101.64 -28.3 12.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.305 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.08 23.85 3.45 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.251 -0.976 . . . . 0.0 114.096 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.942 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.8 -163.13 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 178.924 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.865 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.92 154.13 34.06 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 0.0 110.945 180.0 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.865 ' HD2' HG22 ' A' ' 41' ' ' THR . 85.8 Cg_exo -47.42 -27.12 6.79 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.707 2.271 . . . . 0.0 112.382 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.559 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -88.47 -29.96 19.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.501 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.942 ' HB2' HG22 ' A' ' 40' ' ' ILE . 33.7 mm-40 -80.38 -58.75 2.98 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.775 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.97 HG11 ' O ' ' A' ' 31' ' ' LYS . 26.9 m -34.79 -40.36 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.817 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -71.54 -61.58 1.72 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.783 179.264 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.542 HG23 ' N ' ' A' ' 48' ' ' TRP . 16.8 m -64.6 -43.59 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 121.427 0.632 . . . . 0.0 111.386 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.578 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -62.88 -51.45 66.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.249 -178.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.631 ' CE1' HG11 ' A' ' 19' ' ' VAL . 22.1 m-85 -70.2 -19.64 63.16 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.895 179.282 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.574 HG22 ' N ' ' A' ' 51' ' ' ASN . 1.3 mm -59.63 -66.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.28 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.574 ' N ' HG22 ' A' ' 50' ' ' ILE . 31.3 m120 -66.58 -39.77 88.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.244 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.455 ' HG3' ' CE3' ' A' ' 48' ' ' TRP . 19.9 mmtt -70.02 -57.08 5.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.11 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.498 ' O ' ' N ' ' A' ' 55' ' ' ARG . 7.7 ttm180 -98.75 32.49 2.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.634 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.405 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.0 ttp -51.87 86.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.964 0.412 . . . . 0.0 110.755 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.7 mmp_? -73.44 -38.32 65.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.062 -179.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -136.51 -168.02 2.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.044 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.9 mptt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.89 179.962 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.831 0.348 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 5.1 tttp 58.27 84.07 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.906 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -131.47 -60.78 0.93 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.85 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -127.34 -41.15 1.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.066 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.93 153.31 0.14 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.923 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.38 64.73 2.84 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.525 2.15 . . . . 0.0 112.437 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -112.14 -36.0 5.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.76 -79.44 1.16 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.386 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.84 73.74 0.47 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.848 0.356 . . . . 0.0 110.948 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.1 m -72.43 -56.16 5.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.887 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 m -160.84 139.12 9.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.63 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.663 HG22 ' HB2' ' A' ' 12' ' ' ALA . 8.9 tt -108.46 163.89 5.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.024 0.44 . . . . 0.0 111.404 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.696 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.2 OUTLIER -55.65 -174.08 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.917 179.191 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.696 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.6 Cg_endo -53.22 -21.81 18.13 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.538 1.492 . . . . 0.0 110.971 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.785 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 2.6 mt-30 -50.97 -22.32 2.21 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.012 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.663 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -45.3 -58.07 3.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.25 0.547 . . . . 0.0 109.975 179.025 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.16 -36.72 29.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.726 178.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.785 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.88 -50.48 68.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.178 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.924 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -56.46 -48.23 77.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.395 179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 1.003 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -75.22 -26.37 58.88 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.277 179.474 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -55.84 -58.92 5.83 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.49 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -63.4 -32.04 73.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.984 178.627 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 15' ' ' PHE . 44.4 t -57.97 -59.05 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.117 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.464 ' CE2' ' NE2' ' A' ' 24' ' ' GLN . 10.6 t80 -69.92 -12.79 61.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.409 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.539 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -83.7 -35.45 24.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.477 179.716 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -60.87 -38.56 86.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.213 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.497 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 9.6 ptmt -165.05 -149.3 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.399 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.497 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.3 mm100 -144.25 -49.07 0.28 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.057 0.456 . . . . 0.0 111.749 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.6 t -77.75 68.72 3.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.651 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.947 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.7 mt -75.51 109.33 8.97 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -93.92 176.76 6.22 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.933 0.397 . . . . 0.0 111.235 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.3 m -45.48 -29.46 1.14 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.502 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.423 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 4.1 mmpt? -79.64 -45.32 19.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.039 0.447 . . . . 0.0 110.558 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.4 mt-10 -72.41 -35.93 68.5 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.717 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.966 ' O ' HG11 ' A' ' 45' ' ' VAL . 24.1 pttt -62.02 -34.88 77.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.944 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -89.24 -36.35 15.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.403 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.423 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -74.65 -36.46 62.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.789 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.823 HG11 HG13 ' A' ' 19' ' ' VAL . 74.9 t -78.83 -38.09 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.359 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.723 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.4 -32.03 72.8 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.67 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -88.05 -20.66 25.46 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -25.93 13.08 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.027 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.789 ' SG ' HG22 ' A' ' 19' ' ' VAL . 73.2 m -98.7 -27.48 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.63 26.32 3.41 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.03 -1.081 . . . . 0.0 113.671 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.942 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -114.02 -163.65 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.932 0.366 . . . . 0.0 110.092 179.043 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.89 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -149.91 156.9 38.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.3 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.89 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.9 Cg_exo -49.91 -24.87 11.12 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.647 2.231 . . . . 0.0 112.338 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.1 tp -89.61 -29.4 18.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.571 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.942 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.7 mm-40 -80.48 -58.62 3.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.807 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.966 HG11 ' O ' ' A' ' 31' ' ' LYS . 26.4 m -36.35 -31.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.618 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.557 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.76 -50.68 7.38 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.041 179.904 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.553 HG23 ' N ' ' A' ' 48' ' ' TRP . 25.5 m -75.58 -43.08 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.463 0.649 . . . . 0.0 110.732 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 1.003 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -63.21 -51.26 67.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.821 -179.618 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.947 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.2 m-30 -69.11 -18.04 63.92 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.549 0.214 . . . . 0.0 110.943 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.557 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -64.04 -59.33 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.535 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.503 ' N ' HG22 ' A' ' 50' ' ' ILE . 98.3 m-20 -75.28 -28.64 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.326 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.845 ' HG3' HD22 ' A' ' 16' ' ' LEU . 11.5 mmtp -84.57 -32.64 23.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.343 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -128.53 38.21 4.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.207 -179.608 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 ttm -55.84 85.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.85 0.357 . . . . 0.0 110.831 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.1 mmp_? -86.09 -51.46 6.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.958 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -54.08 105.07 0.12 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.135 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.9 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.82 0.343 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -78.87 124.86 28.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.917 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 43.21 94.1 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.473 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -28.8 28.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.359 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.45 ' CB ' ' HD3' ' A' ' 2' ' ' PRO . 0.3 OUTLIER -52.73 -53.6 52.52 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.094 -179.703 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.45 ' HD3' ' CB ' ' A' ' 1' ' ' SER . 23.4 Cg_exo -64.26 -25.64 64.59 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.505 2.137 . . . . 0.0 112.073 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.75 79.73 0.25 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.771 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 128.65 -113.62 1.62 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.438 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.41 68.3 0.09 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.17 -169.39 2.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.953 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 m 61.94 115.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.852 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.824 HG22 ' HB2' ' A' ' 12' ' ' ALA . 8.6 tt -137.01 167.57 23.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.083 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.68 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -52.86 -175.46 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.211 179.325 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.68 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.7 Cg_endo -53.75 -22.42 23.1 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.581 1.521 . . . . 0.0 110.995 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.769 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 2.8 mp0 -51.92 -23.69 5.31 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.851 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.824 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -45.7 -57.66 4.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.29 0.567 . . . . 0.0 110.087 179.108 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.82 -36.07 32.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.592 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.769 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.66 -53.55 39.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.525 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.903 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.5 -46.92 76.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.581 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 1.05 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -77.78 -25.18 48.88 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.354 179.558 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.6 mm-40 -55.64 -56.2 23.15 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.27 -33.96 76.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.947 178.692 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.903 HG23 ' O ' ' A' ' 15' ' ' PHE . 41.9 t -55.18 -59.92 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.059 0.457 . . . . 0.0 109.797 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.49 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 25.1 t80 -71.06 -10.93 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.759 179.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.554 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -78.03 -42.35 32.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.073 0.463 . . . . 0.0 110.476 179.868 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.98 -45.3 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.78 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.463 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -153.15 -155.36 0.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.192 179.682 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.428 ' O ' ' CD ' ' A' ' 53' ' ' ARG . 20.2 mm-40 -140.31 -48.01 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.976 0.417 . . . . 0.0 111.456 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -82.29 78.17 8.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.457 -178.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.945 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.6 OUTLIER -80.11 125.46 29.84 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.592 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.87 -177.93 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.735 0.302 . . . . 0.0 110.551 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.421 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 4.3 t -52.79 -26.16 13.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.142 0.496 . . . . 0.0 110.548 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.99 -48.55 14.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.682 179.608 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.9 mm-40 -72.23 -36.51 69.14 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.644 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.979 ' O ' HG11 ' A' ' 45' ' ' VAL . 33.7 pttt -60.3 -35.49 75.71 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.023 0.439 . . . . 0.0 109.889 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.592 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.3 -35.82 66.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.871 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.845 HG11 HG13 ' A' ' 19' ' ' VAL . 90.4 t -79.95 -39.48 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.494 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.713 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -61.13 -31.66 71.36 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -87.48 -21.18 25.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 2.8 pttt -104.63 -26.06 12.48 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.624 -179.125 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.79 ' SG ' HG22 ' A' ' 19' ' ' VAL . 73.2 m -96.4 -27.49 14.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.258 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.79 21.9 4.85 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.71 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 1.006 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.26 -162.3 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.989 0.394 . . . . 0.0 110.22 179.146 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.889 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -153.57 155.41 31.5 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.624 0.249 . . . . 0.0 110.812 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.889 ' HD2' HG22 ' A' ' 41' ' ' THR . 79.0 Cg_exo -48.04 -27.09 8.5 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.593 2.195 . . . . 0.0 112.331 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.476 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 17.0 tp -89.06 -27.82 20.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 1.006 ' HB2' HG22 ' A' ' 40' ' ' ILE . 3.4 mm100 -82.64 -57.51 3.3 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.782 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.979 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.1 m -36.12 -33.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.299 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.523 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -82.79 -53.53 5.82 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.901 179.579 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.623 HG22 ' HA ' ' A' ' 44' ' ' GLN . 19.8 m -69.9 -42.71 79.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 121.395 0.617 . . . . 0.0 110.777 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 1.05 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -64.35 -53.44 48.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.741 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.945 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.4 m-30 -67.76 -14.06 62.63 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.753 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.523 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.8 OUTLIER -67.38 -56.93 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.854 0.359 . . . . 0.0 110.379 179.817 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.485 ' N ' HG22 ' A' ' 50' ' ' ILE . 31.2 m120 -73.26 -30.6 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.047 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.93 ' HG3' HD22 ' A' ' 16' ' ' LEU . 2.3 mmtp -82.47 -42.5 18.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.851 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.49 ' HG3' ' CE1' ' A' ' 20' ' ' PHE . 16.9 ttp85 -116.77 38.43 3.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.411 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.418 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -55.01 85.17 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.815 0.34 . . . . 0.0 111.005 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -89.65 -61.97 1.58 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.709 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.4 t -109.09 85.89 2.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.754 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.5 pttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.15 -0.929 . . . . 0.0 111.48 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.646 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.646 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.54 -22.87 13.46 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.565 1.51 . . . . 0.0 110.916 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.75 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 26.7 mt-30 -49.36 -25.16 2.27 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.929 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.24 -56.08 5.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.228 0.537 . . . . 0.0 109.91 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.69 -36.19 28.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.679 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.75 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.73 -55.79 15.49 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.499 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.977 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.3 -52.4 63.56 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.491 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.72 HD11 ' HB3' ' A' ' 52' ' ' LYS . 1.6 tp -63.88 -34.25 77.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.987 178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -52.38 -65.01 0.63 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.316 179.584 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -60.73 -32.27 71.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.833 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.977 HG23 ' O ' ' A' ' 15' ' ' PHE . 89.1 t -59.03 -67.26 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.466 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 28.8 t80 -60.85 -17.53 50.69 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.981 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.564 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.67 -38.22 54.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.88 0.372 . . . . 0.0 110.68 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -59.27 -38.92 81.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.443 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.473 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -170.16 -147.57 0.06 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.804 179.805 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.8 mm-40 -140.41 -51.96 0.48 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.179 0.514 . . . . 0.0 110.983 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.5 t -77.6 70.88 4.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.332 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.975 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.9 mt -74.08 106.38 5.73 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.411 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 4.0 p30 -87.48 178.19 6.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.824 0.345 . . . . 0.0 111.658 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.4 m -48.07 -29.29 3.43 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.445 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.421 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.7 mmpt? -77.63 -47.5 19.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.52 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 22.6 mt-10 -73.03 -35.73 66.81 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.945 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.967 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.1 pttt -61.45 -33.87 74.46 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.029 0.442 . . . . 0.0 109.908 179.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -90.49 -36.49 14.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.421 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.1 mm-40 -74.67 -35.57 62.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.859 HG11 HG13 ' A' ' 19' ' ' VAL . 81.9 t -78.96 -37.88 20.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.3 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.704 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.81 -30.19 71.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.098 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -87.34 -21.06 25.92 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.46 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.6 OUTLIER -103.51 -28.91 11.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.636 0.255 . . . . 0.0 111.428 -179.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.706 ' SG ' HG22 ' A' ' 19' ' ' VAL . 78.9 m -92.71 -27.84 17.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.289 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.92 24.29 4.95 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.377 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.888 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.97 -163.91 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.025 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.874 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.27 156.5 37.29 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.761 0.315 . . . . 0.0 111.148 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.874 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.1 Cg_exo -49.65 -24.9 10.27 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.687 2.258 . . . . 0.0 112.292 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.2 OUTLIER -90.0 -27.71 19.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.608 179.775 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.888 ' HB2' HG22 ' A' ' 40' ' ' ILE . 33.0 mm-40 -82.57 -58.27 2.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.843 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.967 HG11 ' O ' ' A' ' 31' ' ' LYS . 24.9 m -36.67 -32.61 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.282 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.532 ' O ' HG12 ' A' ' 50' ' ' ILE . 1.1 ptp85 -82.37 -60.57 2.16 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.76 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.543 HG23 ' N ' ' A' ' 48' ' ' TRP . 17.2 m -67.87 -44.58 85.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.329 0.585 . . . . 0.0 111.33 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.579 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.85 -52.83 63.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.797 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.975 ' CE2' HD12 ' A' ' 26' ' ' LEU . 18.2 m-30 -64.85 -28.0 69.26 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.714 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.8 mm -53.89 -51.67 42.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.66 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -80.13 -30.65 39.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.695 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.72 ' HB3' HD11 ' A' ' 16' ' ' LEU . 14.6 mmtt -94.94 18.78 11.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.103 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 49' ' ' PHE . 3.6 ttm105 -179.84 33.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.077 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.4 ttt . . . . . 0 C--N 1.332 -0.191 0 CA-C-O 120.882 0.373 . . . . 0.0 110.851 -179.93 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.662 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.168 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.662 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.87 -24.45 13.67 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 121.643 1.562 . . . . 0.0 110.964 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.759 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 29.2 mt-30 -47.63 -27.36 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.699 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.38 -55.85 3.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.184 0.516 . . . . 0.0 110.038 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.66 -36.44 28.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.759 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.06 -56.01 15.52 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.643 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.956 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -56.11 -50.71 70.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.562 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.657 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.1 tp -65.5 -31.71 72.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.918 178.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.478 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 4.0 mt-10 -56.33 -56.15 24.68 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.393 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.466 ' HA ' ' HD3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.48 -24.39 62.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.997 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.956 HG23 ' O ' ' A' ' 15' ' ' PHE . 89.5 t -73.08 -64.22 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.01 0.433 . . . . 0.0 110.951 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.438 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 21.4 t80 -61.82 -17.67 57.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.902 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 1.0 OUTLIER -79.53 -38.49 34.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.518 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -59.27 -38.55 80.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.0 ptmt -169.95 -145.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.564 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.513 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 21.5 mm-40 -144.59 -50.04 0.27 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.997 0.427 . . . . 0.0 111.412 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -81.82 71.88 8.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.417 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.988 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.5 mt -73.3 108.94 6.46 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.4 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 4.9 p30 -85.03 176.38 8.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.757 0.313 . . . . 0.0 111.06 -179.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.402 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.5 m -45.9 -29.96 1.57 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.417 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.1 mmpt? -77.65 -48.74 16.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.842 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 mt-10 -70.79 -38.82 73.37 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.892 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.974 ' O ' HG11 ' A' ' 45' ' ' VAL . 2.6 pttt -59.58 -34.33 72.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.017 0.436 . . . . 0.0 110.127 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -90.66 -37.42 13.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.633 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -73.51 -34.53 65.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.553 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.835 HG11 HG13 ' A' ' 19' ' ' VAL . 89.5 t -80.74 -38.8 17.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.402 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.693 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.4 -31.13 72.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.916 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -87.58 -19.95 27.11 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.474 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.02 -24.87 12.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.643 0.259 . . . . 0.0 111.551 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.744 ' SG ' HG22 ' A' ' 19' ' ' VAL . 74.0 m -97.5 -26.67 14.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.291 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.87 25.41 4.53 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.407 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.918 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.55 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.085 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.883 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.94 157.15 40.61 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.883 ' HD2' HG22 ' A' ' 41' ' ' THR . 78.4 Cg_exo -50.41 -24.53 12.28 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.663 2.242 . . . . 0.0 112.269 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.3 tp -89.9 -28.13 19.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.731 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.918 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.8 mm-40 -81.5 -57.98 3.23 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.126 0.488 . . . . 0.0 109.823 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.974 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.7 m -36.32 -32.82 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.615 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.506 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -83.78 -57.98 2.99 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.8 179.665 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.54 HG23 ' N ' ' A' ' 48' ' ' TRP . 21.6 m -68.66 -43.55 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 111.218 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.54 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.66 -53.91 47.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.018 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.988 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.1 m-30 -64.36 -28.9 70.01 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.427 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.2 -52.87 26.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.913 0.387 . . . . 0.0 110.599 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -79.0 -30.59 44.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.638 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.657 ' HB3' HD11 ' A' ' 16' ' ' LEU . 49.7 mmtt -93.89 19.19 9.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.924 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 29.2 ttp180 -177.5 31.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.976 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.2 0 CA-C-O 120.902 0.382 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.682 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.303 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.682 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.9 Cg_endo -51.95 -23.29 16.25 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.759 1.639 . . . . 0.0 111.177 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.79 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -51.2 -23.44 3.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.137 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.69 -57.05 6.0 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.2 0.524 . . . . 0.0 109.852 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -80.99 -34.66 32.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.554 178.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.79 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.16 -56.47 12.7 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.239 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.989 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.03 -51.16 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.903 179.595 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.567 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.6 tp -68.53 -31.77 71.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.309 178.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.0 mt-10 -52.47 -57.72 8.99 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.318 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -68.77 -35.99 77.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.899 179.647 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.989 HG23 ' O ' ' A' ' 15' ' ' PHE . 86.6 t -58.52 -64.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-O 120.911 0.386 . . . . 0.0 110.137 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.412 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 63.2 t80 -60.72 -16.19 37.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.169 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.67 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -78.9 -39.21 35.57 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 110.805 179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.5 mtp85 -59.54 -40.34 86.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.884 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.509 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -163.33 -147.87 0.12 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.935 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.412 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 30.2 mm-40 -139.05 -49.43 0.51 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.436 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -99.19 91.17 4.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.067 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.877 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.8 mt -78.91 136.74 37.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.101 178.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.72 175.8 6.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.243 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.1 m -51.54 -26.12 7.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.467 . . . . 0.0 110.878 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.426 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -80.01 -47.5 14.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.582 179.673 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.497 ' O ' HG23 ' A' ' 34' ' ' VAL . 2.9 mm-40 -71.63 -37.73 70.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.633 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.965 ' O ' HG11 ' A' ' 45' ' ' VAL . 11.9 pttm -60.29 -35.77 76.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.77 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -89.0 -36.17 15.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.701 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.426 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 8.8 mm-40 -75.18 -36.09 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.728 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.832 HG11 HG13 ' A' ' 19' ' ' VAL . 82.1 t -78.24 -39.37 24.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.01 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.716 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.09 -30.41 71.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.98 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -87.58 -20.52 26.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.443 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 20.2 ptmt -105.07 -26.08 12.26 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.466 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 70.8 m -94.79 -28.2 15.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.101 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.09 23.57 4.85 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.309 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.94 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.78 -162.59 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.113 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.837 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -151.8 153.95 32.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.858 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.837 ' HD2' HG22 ' A' ' 41' ' ' THR . 85.7 Cg_exo -47.28 -26.31 5.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.713 2.275 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.481 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 8.8 tp -88.05 -28.56 21.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.658 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.94 ' HB2' HG22 ' A' ' 40' ' ' ILE . 34.8 mm-40 -81.74 -58.14 3.13 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.068 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.965 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.3 m -36.27 -33.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.395 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.525 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -82.05 -58.75 2.83 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.792 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.551 HG23 ' N ' ' A' ' 48' ' ' TRP . 24.3 m -67.82 -43.66 86.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.271 0.558 . . . . 0.0 111.278 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.567 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.77 -54.23 45.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.018 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.877 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -63.7 -29.34 70.58 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 120.674 0.273 . . . . 0.0 110.6 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.4 mm -52.28 -56.06 8.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.747 0.308 . . . . 0.0 110.912 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.405 ' N ' HG22 ' A' ' 50' ' ' ILE . 8.2 m-80 -77.76 -31.16 51.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.506 ' HB3' HD11 ' A' ' 16' ' ' LEU . 52.8 mmtt -90.11 11.63 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.133 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' A' ' 49' ' ' PHE . 9.5 ttp180 -170.57 32.35 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.165 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.965 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.652 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.271 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.652 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.37 -23.9 14.87 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.684 1.589 . . . . 0.0 110.985 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.753 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 27.8 mt-30 -49.35 -26.62 3.28 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.832 179.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.08 -55.84 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.338 0.59 . . . . 0.0 110.038 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.402 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -81.49 -36.56 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.612 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.753 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.7 -57.53 7.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.581 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.962 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -54.31 -52.02 62.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.005 179.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.663 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.0 tp -64.95 -34.58 78.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.581 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.32 -64.12 0.91 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.362 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -62.75 -34.54 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.974 179.699 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.962 HG23 ' O ' ' A' ' 15' ' ' PHE . 74.9 t -58.58 -65.5 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-O 120.816 0.341 . . . . 0.0 110.137 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -61.34 -15.54 36.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.21 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.581 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.94 -36.27 28.19 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 120.899 0.38 . . . . 0.0 111.063 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -58.87 -37.87 77.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.587 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.451 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.0 ptmt -163.19 -138.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.331 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.436 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 19.5 mm-40 -147.9 -46.5 0.16 Allowed 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.516 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.1 t -100.36 82.92 2.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.054 HD12 ' CE2' ' A' ' 49' ' ' PHE . 5.0 mt -74.95 125.04 28.04 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 176.31 6.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.749 0.309 . . . . 0.0 110.951 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.41 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 37.1 t -45.88 -29.82 1.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.142 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.0 mmpt? -78.19 -48.06 16.7 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.515 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.494 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.7 mt-10 -70.1 -40.15 75.11 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.976 ' O ' HG11 ' A' ' 45' ' ' VAL . 7.3 pttt -58.76 -34.63 71.62 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.16 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.08 -37.01 14.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.678 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -73.88 -34.71 64.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.583 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.821 HG11 HG13 ' A' ' 19' ' ' VAL . 82.4 t -80.29 -38.07 17.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.327 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.682 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.31 -30.9 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.935 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -87.61 -19.22 28.08 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -25.27 13.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 0.0 111.574 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.721 ' SG ' HG22 ' A' ' 19' ' ' VAL . 56.9 m -96.99 -30.22 13.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.064 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.04 22.58 4.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.208 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.917 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -107.05 -163.26 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.87 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -149.98 155.54 37.81 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.674 0.273 . . . . 0.0 111.081 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.87 ' HD2' HG22 ' A' ' 41' ' ' THR . 73.5 Cg_exo -48.79 -29.41 14.77 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.499 2.133 . . . . 0.0 112.037 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.707 HD12 ' HD2' ' A' ' 46' ' ' ARG . 22.5 tp -84.32 -26.93 28.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.683 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.917 ' HB2' HG22 ' A' ' 40' ' ' ILE . 5.6 mm-40 -83.35 -59.19 2.54 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.976 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.6 m -36.25 -33.89 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.112 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.791 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -80.68 -58.77 2.95 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.934 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.791 HG13 ' HD3' ' A' ' 46' ' ' ARG . 21.9 m -69.0 -44.28 81.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.361 0.6 . . . . 0.0 111.344 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.565 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.45 -52.8 63.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.023 -179.424 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 1.054 ' CE2' HD12 ' A' ' 26' ' ' LEU . 21.6 m-30 -66.79 -24.76 66.23 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.715 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -55.51 -53.95 30.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.872 0.368 . . . . 0.0 110.369 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -80.83 -30.09 35.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.626 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.663 ' HB3' HD11 ' A' ' 16' ' ' LEU . 63.3 mmtt -93.23 14.94 16.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.021 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.527 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 6.5 ttp180 -178.14 36.37 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.167 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-O 121.051 0.453 . . . . 0.0 110.299 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.66 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.66 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.1 Cg_endo -51.73 -23.08 14.72 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.678 1.585 . . . . 0.0 110.999 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.77 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 27.9 mt-30 -49.85 -25.31 3.03 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.865 179.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.4 -56.23 4.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.313 0.578 . . . . 0.0 109.877 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 2.6 ptt85 -81.37 -37.64 27.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.564 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.77 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.57 -56.83 12.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.926 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -54.03 -51.45 63.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.033 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.666 HD11 ' HB3' ' A' ' 52' ' ' LYS . 1.8 tp -64.46 -34.18 77.61 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.572 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.4 -67.08 0.28 Allowed 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.148 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -35.69 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.073 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.926 HG23 ' O ' ' A' ' 15' ' ' PHE . 71.8 t -56.14 -67.73 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.932 0.396 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.41 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 46.7 t80 -61.26 -15.93 40.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.372 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.07 -37.75 28.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.861 0.363 . . . . 0.0 111.005 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.9 mtp-105 -59.99 -37.52 79.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.637 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.451 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.48 -150.35 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.318 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.41 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 32.0 mm-40 -141.68 -46.48 0.36 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.987 0.423 . . . . 0.0 111.489 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.1 t -84.55 77.85 9.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.244 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.987 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.0 mt -80.67 109.86 15.62 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -97.49 -176.12 3.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.301 . . . . 0.0 111.317 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.5 m -48.55 -30.9 5.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.42 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.4 mmpt? -77.0 -48.49 17.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.685 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.0 mm-40 -70.69 -39.15 73.66 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.984 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.974 ' O ' HG11 ' A' ' 45' ' ' VAL . 34.6 pttt -58.44 -34.44 70.83 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.089 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -91.82 -36.69 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.736 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.428 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -74.21 -35.38 63.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.646 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.847 HG11 HG13 ' A' ' 19' ' ' VAL . 91.0 t -79.97 -39.86 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.654 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.75 -30.04 71.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.099 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.41 -19.82 27.54 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.45 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -106.69 -21.74 12.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.632 0.253 . . . . 0.0 111.518 -179.467 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.743 ' SG ' HG22 ' A' ' 19' ' ' VAL . 71.6 m -99.31 -26.62 14.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.259 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.57 26.25 4.58 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.329 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.911 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.57 -167.92 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.262 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.855 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -143.04 155.68 62.11 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 111.076 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.855 ' HD2' HG22 ' A' ' 41' ' ' THR . 77.8 Cg_exo -50.26 -25.13 12.81 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.616 2.211 . . . . 0.0 112.28 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.559 ' O ' HD12 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -89.22 -26.28 21.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.626 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.911 ' HB2' HG22 ' A' ' 40' ' ' ILE . 29.4 mm-40 -82.26 -58.83 2.77 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.974 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.3 m -36.62 -33.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.404 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.54 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -81.43 -59.48 2.61 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.681 179.576 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.556 HG23 ' N ' ' A' ' 48' ' ' TRP . 20.4 m -69.21 -44.32 80.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.285 0.565 . . . . 0.0 111.379 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.556 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.43 -51.99 66.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.065 -179.447 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.987 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.7 m-30 -67.05 -27.3 67.28 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.674 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.44 -53.88 21.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.584 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -79.92 -29.52 39.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.666 ' HB3' HD11 ' A' ' 16' ' ' LEU . 63.5 mmtt -93.57 17.41 11.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 49' ' ' PHE . 22.7 ttp180 -178.18 32.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.193 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.4 ttm . . . . . 0 C--N 1.331 -0.198 0 CA-C-O 120.931 0.396 . . . . 0.0 111.069 -179.89 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.684 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.684 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.9 Cg_endo -49.8 -24.04 9.47 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.692 1.595 . . . . 0.0 110.998 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.774 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 28.4 mt-30 -46.46 -27.62 1.14 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.91 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.25 -57.06 3.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 110.074 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.413 ' O ' ' N ' ' A' ' 17' ' ' GLU . 1.2 ptm180 -81.13 -35.43 31.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.771 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.774 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.8 -56.59 11.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 120.985 0.421 . . . . 0.0 111.145 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.985 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -52.63 -50.09 63.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.879 179.353 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.619 HD22 ' CG ' ' A' ' 52' ' ' LYS . 0.5 OUTLIER -67.93 -36.21 79.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.801 178.825 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.625 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.7 mt-10 -48.21 -60.54 2.56 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.157 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -65.11 -35.01 79.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.264 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.985 HG23 ' O ' ' A' ' 15' ' ' PHE . 87.8 t -58.12 -65.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 110.035 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.428 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 19.3 t80 -60.72 -17.83 50.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.949 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.625 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.8 -38.87 53.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.952 0.405 . . . . 0.0 110.84 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.38 -41.79 90.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.644 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -164.23 -144.59 0.08 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.631 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.513 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 20.2 mm-40 -145.45 -48.47 0.23 Allowed 'General case' 0 C--N 1.334 -0.081 0 CA-C-O 120.881 0.372 . . . . 0.0 111.563 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.3 t -86.01 73.36 10.31 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.999 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.3 mt -73.16 113.45 10.23 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 6.5 p30 -88.2 178.13 6.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.736 0.303 . . . . 0.0 110.99 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -47.44 -28.68 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.001 0.429 . . . . 0.0 111.045 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.0 OUTLIER -77.1 -50.62 12.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.914 179.883 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.5 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 8.7 mt-10 -70.56 -38.9 74.19 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.82 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.992 ' O ' HG11 ' A' ' 45' ' ' VAL . 19.7 pttt -59.05 -34.89 72.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.151 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -90.5 -37.6 13.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.699 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.04 -34.28 66.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.633 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.842 HG11 HG13 ' A' ' 19' ' ' VAL . 92.7 t -81.75 -38.66 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.629 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.707 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.73 -33.72 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.992 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.8 pttm -87.58 -18.83 28.81 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -25.67 13.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.667 0.27 . . . . 0.0 111.44 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.746 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.8 m -98.51 -29.57 13.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.138 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.28 22.96 3.97 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.415 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.899 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.08 -163.77 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 179.12 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.848 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.98 154.45 39.69 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.788 0.328 . . . . 0.0 110.984 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.848 ' HD2' HG22 ' A' ' 41' ' ' THR . 76.3 Cg_exo -47.98 -27.61 9.08 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.61 2.206 . . . . 0.0 112.289 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.454 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.1 tp -85.83 -28.3 24.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.693 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.899 ' HB2' HG22 ' A' ' 40' ' ' ILE . 37.5 mm-40 -82.06 -58.84 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.899 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.992 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.9 m -35.94 -33.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.375 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.691 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -82.29 -56.87 3.65 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.05 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.691 HG13 ' HD3' ' A' ' 46' ' ' ARG . 21.5 m -71.55 -43.79 71.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.254 0.55 . . . . 0.0 111.301 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.555 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.61 -55.03 35.09 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.716 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.999 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.5 m-30 -62.71 -22.52 66.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 120.722 0.296 . . . . 0.0 110.443 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -64.48 -52.01 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.166 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -79.82 -34.59 39.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.05 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.619 ' CG ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -80.27 -26.5 38.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.132 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.484 ' N ' ' O ' ' A' ' 49' ' ' PHE . 8.6 ttm180 -133.24 35.39 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.718 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 4.3 ttm . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.744 179.586 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.658 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.658 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.5 Cg_endo -50.52 -24.32 12.27 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.821 1.681 . . . . 0.0 110.876 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.745 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 28.3 mt-30 -48.46 -25.71 1.79 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.87 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.63 -55.27 5.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 0.0 109.935 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -81.93 -37.11 27.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.861 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.745 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.83 -55.08 21.75 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.506 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.964 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.31 -51.88 65.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.014 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.695 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.8 tp -66.05 -33.56 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.638 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.7 mm-40 -51.29 -64.47 0.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -61.34 -36.4 80.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.481 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.964 HG23 ' O ' ' A' ' 15' ' ' PHE . 93.4 t -58.52 -66.85 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.417 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 65.6 t80 -59.51 -18.24 38.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.818 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.638 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -75.39 -39.8 58.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.982 0.42 . . . . 0.0 110.618 179.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.515 ' NH1' HG22 ' A' ' 34' ' ' VAL . 49.0 mtp180 -59.52 -40.0 85.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.706 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.5 ptmt -168.89 -144.75 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.427 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.513 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.5 mm-40 -144.58 -50.25 0.27 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 111.38 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.8 t -85.83 74.39 10.2 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.986 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.9 mt -72.75 129.4 38.11 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.48 -179.65 4.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.753 0.311 . . . . 0.0 110.655 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.405 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 6.0 m -52.21 -26.94 12.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.19 0.519 . . . . 0.0 110.262 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.44 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.14 -50.23 12.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.61 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.494 ' O ' HG23 ' A' ' 34' ' ' VAL . 1.6 mt-10 -70.67 -39.37 73.6 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.815 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.3 pttp -59.0 -34.88 72.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.224 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -90.31 -37.85 13.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.578 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.44 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 5.0 mm-40 -73.13 -35.62 66.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.621 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.822 HG11 HG13 ' A' ' 19' ' ' VAL . 94.3 t -79.63 -38.5 19.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.163 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.694 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.32 -33.42 75.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.336 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -88.22 -19.95 26.17 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.411 ' CG ' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -101.91 -28.84 12.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.62 -179.111 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.741 ' SG ' HG22 ' A' ' 19' ' ' VAL . 71.4 m -95.9 -29.36 14.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.154 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.94 26.88 2.89 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.344 -0.932 . . . . 0.0 113.579 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.878 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -113.1 -161.91 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.053 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.773 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -149.99 151.25 31.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.495 0.188 . . . . 0.0 110.704 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.773 ' HD2' HG22 ' A' ' 41' ' ' THR . 4.7 Cg_endo -47.12 -27.42 6.31 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.83 2.354 . . . . 0.0 112.195 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 10.5 tp -84.81 -28.74 25.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.525 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.878 ' HB2' HG22 ' A' ' 40' ' ' ILE . 38.8 mm-40 -81.74 -58.1 3.15 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.84 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.2 m -36.2 -33.16 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.581 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.529 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -83.31 -55.85 4.09 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.831 179.662 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.552 HG23 ' N ' ' A' ' 48' ' ' TRP . 28.7 m -70.8 -44.03 76.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.344 0.593 . . . . 0.0 111.368 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.695 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.15 -53.24 58.2 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.124 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.986 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -65.48 -27.41 68.48 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.699 0.285 . . . . 0.0 110.601 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -54.59 -55.17 16.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.804 0.335 . . . . 0.0 110.763 -179.775 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.407 ' N ' HG22 ' A' ' 50' ' ' ILE . 49.5 m-80 -79.53 -29.97 41.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.716 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.437 ' HB3' HD11 ' A' ' 16' ' ' LEU . 23.5 mmtt -90.24 10.53 24.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.15 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.48 ' N ' ' O ' ' A' ' 49' ' ' PHE . 12.1 ttp180 -170.38 32.27 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.491 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-O 120.97 0.414 . . . . 0.0 110.76 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.686 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.686 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.4 Cg_endo -50.87 -24.42 13.58 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.846 1.697 . . . . 0.0 110.965 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.776 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 1.1 mt-30 -49.95 -23.47 2.01 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.031 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.19 -55.8 7.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.143 0.497 . . . . 0.0 109.948 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -81.26 -35.31 31.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.635 178.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.776 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.5 -55.29 18.7 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.168 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 1.006 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.08 -50.84 63.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.841 179.526 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.76 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.2 tp -69.14 -32.24 71.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.655 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -51.47 -56.98 10.33 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.117 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -69.38 -34.31 74.35 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.717 179.417 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 1.006 HG23 ' O ' ' A' ' 15' ' ' PHE . 90.7 t -58.54 -67.03 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.843 0.354 . . . . 0.0 110.046 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.404 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 23.8 t80 -59.1 -16.91 21.86 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.951 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.655 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.91 -40.5 47.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.028 0.442 . . . . 0.0 111.046 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.8 -38.82 79.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.035 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.471 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -166.27 -139.58 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.467 179.649 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.471 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 16.0 mm-40 -148.27 -46.88 0.16 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.917 0.389 . . . . 0.0 111.362 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 53' ' ' ARG . 20.8 t -93.61 78.27 4.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.328 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.06 HD12 ' CE2' ' A' ' 49' ' ' PHE . 4.5 mt -74.13 121.36 21.04 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -90.36 177.02 6.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.745 0.307 . . . . 0.0 110.879 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -48.25 -28.19 2.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.952 0.406 . . . . 0.0 111.071 179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 5.6 mmpt? -78.36 -48.4 15.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.635 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 5.2 mt-10 -70.96 -37.78 72.81 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.884 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.978 ' O ' HG11 ' A' ' 45' ' ' VAL . 35.2 pttt -60.3 -34.82 74.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.038 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -90.06 -37.45 14.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.549 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 9.6 mm-40 -73.47 -35.41 65.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.642 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.847 HG11 HG13 ' A' ' 19' ' ' VAL . 86.3 t -80.09 -37.76 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.295 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.683 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.5 -32.02 73.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.477 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.6 ptmt -87.7 -19.34 27.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.328 -0.396 . . . . 0.0 112.032 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.59 -27.37 12.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.624 0.249 . . . . 0.0 111.492 -179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.742 ' SG ' HG22 ' A' ' 19' ' ' VAL . 77.8 m -96.64 -29.0 14.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.24 24.88 4.0 Favored Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.306 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.85 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.4 -165.43 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.06 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.776 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -146.27 151.77 44.98 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 120.573 0.225 . . . . 0.0 110.624 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.776 ' HD2' HG22 ' A' ' 41' ' ' THR . 4.8 Cg_endo -46.9 -29.1 7.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.745 2.296 . . . . 0.0 112.148 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 31.7 tp -82.42 -29.31 30.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.589 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.85 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.4 mm-40 -81.44 -58.91 2.82 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.897 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.978 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.2 m -35.89 -33.39 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.483 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.565 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.5 OUTLIER -82.56 -56.38 3.9 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.793 179.609 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.565 HG13 ' HD3' ' A' ' 46' ' ' ARG . 27.5 m -69.84 -43.3 79.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.402 0.62 . . . . 0.0 111.117 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.76 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.32 -53.78 50.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.982 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 1.06 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.6 m-30 -66.55 -20.49 66.03 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.657 0.265 . . . . 0.0 110.741 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -59.85 -59.99 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.181 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.488 ' N ' HG22 ' A' ' 50' ' ' ILE . 5.5 p30 -72.94 -43.1 62.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.406 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.506 ' HG3' HD22 ' A' ' 16' ' ' LEU . 43.5 mmtt -71.18 -33.64 70.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.595 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.581 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 2.3 tmt_? -123.13 34.59 5.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.471 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 4.9 ttp . . . . . 0 C--N 1.332 -0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.916 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.686 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.686 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.7 Cg_endo -50.39 -25.02 13.04 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 121.78 1.654 . . . . 0.0 111.082 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.752 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.7 OUTLIER -50.79 -23.67 2.91 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.79 179.115 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -47.89 -54.51 12.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.157 0.503 . . . . 0.0 109.814 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -36.52 27.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.723 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.752 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.22 -54.06 35.11 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.574 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.959 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -58.03 -52.5 65.26 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.659 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.5 tp -63.25 -32.58 74.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.81 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.516 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -53.66 -66.59 0.37 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.097 179.332 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -27.42 66.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.959 HG23 ' O ' ' A' ' 15' ' ' PHE . 98.0 t -70.69 -63.28 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.06 0.457 . . . . 0.0 110.731 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.406 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 61.0 t80 -68.42 -11.51 59.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.544 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.516 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -85.73 -36.62 20.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.57 -179.688 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.229 0.538 . . . . 0.0 110.218 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -162.37 -143.1 0.08 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.951 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.406 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 20.1 mm-40 -147.07 -44.82 0.18 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.543 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -101.54 90.39 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.04 HD12 ' CE2' ' A' ' 49' ' ' PHE . 6.7 mt -86.0 130.54 34.51 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.421 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 3.2 p30 -95.48 -176.65 3.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.426 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 11.3 t -52.13 -29.26 21.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.31 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.02 -47.74 17.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.6 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.517 ' O ' HG23 ' A' ' 34' ' ' VAL . 23.9 mt-10 -72.05 -36.99 69.76 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.818 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.966 ' O ' HG11 ' A' ' 45' ' ' VAL . 4.3 pttp -60.89 -34.24 74.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.02 0.438 . . . . 0.0 109.947 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -90.02 -36.39 14.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.534 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -74.94 -35.11 62.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.59 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.815 HG11 HG13 ' A' ' 19' ' ' VAL . 93.3 t -80.12 -36.78 16.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.666 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.84 -29.64 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.503 . . . . 0.0 112.078 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -87.23 -19.92 27.66 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 5.3 ptmm? -103.93 -26.85 12.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.686 0.279 . . . . 0.0 111.513 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 61.2 m -95.21 -27.72 15.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 113.24 24.72 4.68 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.321 -0.943 . . . . 0.0 113.404 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.953 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.55 -165.36 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.163 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.882 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -146.52 158.02 47.43 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 120.769 0.318 . . . . 0.0 111.203 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.882 ' HD2' HG22 ' A' ' 41' ' ' THR . 56.6 Cg_exo -51.61 -23.76 15.79 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.647 2.231 . . . . 0.0 112.374 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.2 tp -91.6 -25.51 19.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.745 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.953 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.4 mm-40 -82.99 -58.54 2.82 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 109.882 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.966 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.7 m -36.53 -33.23 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.218 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.525 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.75 -59.74 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.767 179.563 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.55 HG23 ' N ' ' A' ' 48' ' ' TRP . 20.6 m -68.53 -44.06 83.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.224 0.535 . . . . 0.0 111.38 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.55 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.41 -54.05 48.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.962 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 1.04 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.8 m-30 -64.23 -29.61 70.71 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.458 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -52.84 -51.68 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.908 0.385 . . . . 0.0 110.573 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -79.63 -29.52 41.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.548 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.659 ' HB3' HD11 ' A' ' 16' ' ' LEU . 52.6 mmtt -94.84 18.36 11.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.9 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' PHE . 12.6 ttp180 -176.27 30.63 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.207 0 CA-C-O 120.866 0.365 . . . . 0.0 110.99 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.1 Cg_endo -52.92 -22.81 19.28 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 121.589 1.526 . . . . 0.0 111.028 179.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.81 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 28.0 mt-30 -49.76 -26.95 4.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.547 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.472 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -41.66 -59.68 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.249 0.547 . . . . 0.0 110.121 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -81.51 -35.21 30.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.701 178.842 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.81 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.2 -57.73 8.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.234 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.888 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -55.35 -45.06 76.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.504 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.564 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -69.9 -31.69 69.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.911 179.123 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.6 OUTLIER -54.36 -64.61 0.78 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.581 179.049 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -32.33 69.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.304 178.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 15' ' ' PHE . 25.0 t -59.02 -57.24 12.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.991 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.411 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 9.0 t80 -73.41 -11.8 60.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.739 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.13 -37.4 28.91 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.504 179.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -60.24 -42.1 94.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.335 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.464 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -160.64 -155.3 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.473 179.746 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.409 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 29.2 mm-40 -139.72 -47.99 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 111.551 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 t -77.9 73.77 4.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.455 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.96 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.7 OUTLIER -80.32 115.72 20.01 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.502 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.59 -177.26 3.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.732 0.301 . . . . 0.0 110.626 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.412 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 0.9 OUTLIER -52.1 -26.48 11.26 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.147 0.499 . . . . 0.0 110.604 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.418 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.54 -49.39 13.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.827 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.0 mm-40 -72.29 -36.45 68.97 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.798 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.979 ' O ' HG11 ' A' ' 45' ' ' VAL . 31.7 pttt -60.67 -34.99 75.13 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.077 0.465 . . . . 0.0 109.882 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -90.1 -35.61 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.69 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -75.54 -35.46 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.741 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.827 HG11 HG13 ' A' ' 19' ' ' VAL . 83.4 t -79.46 -39.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.311 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.736 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -60.81 -34.33 74.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.753 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -87.95 -19.11 27.7 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -19.8 13.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.778 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.9 m -106.34 -27.15 11.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.32 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.3 21.87 4.3 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 120.124 -1.036 . . . . 0.0 114.037 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.929 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.27 -164.77 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.05 0.425 . . . . 0.0 110.166 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.876 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.8 156.98 41.24 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.676 0.275 . . . . 0.0 110.931 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.876 ' HD2' HG22 ' A' ' 41' ' ' THR . 74.1 Cg_exo -49.67 -26.87 13.79 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.62 2.213 . . . . 0.0 112.496 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.4 tp -88.91 -29.01 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 0.0 110.562 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.929 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.8 mm-40 -80.57 -58.23 3.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.77 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.979 HG11 ' O ' ' A' ' 31' ' ' LYS . 22.7 m -35.73 -35.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.508 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.537 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -79.7 -55.39 5.04 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.667 179.526 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.566 HG23 ' N ' ' A' ' 48' ' ' TRP . 29.7 m -69.84 -44.27 79.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.457 0.646 . . . . 0.0 111.202 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.566 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -62.43 -51.49 67.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.211 -179.459 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.96 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.5 m-30 -67.57 -25.73 65.94 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.525 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -56.96 -50.58 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.953 0.406 . . . . 0.0 110.375 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -80.42 -32.23 37.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.523 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -92.95 16.1 13.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.027 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -178.15 35.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.11 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.407 . . . . 0.0 110.654 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.681 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.329 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -52.09 -23.69 17.93 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.81 1.674 . . . . 0.0 110.952 179.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.807 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -52.12 -24.94 7.73 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.661 179.012 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.99 -59.22 2.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.265 0.555 . . . . 0.0 110.081 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -82.07 -34.97 29.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.668 178.858 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.807 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.71 -53.91 43.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.011 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.987 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -57.0 -46.97 81.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.34 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.581 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -69.86 -30.03 67.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.264 179.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.522 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.9 mt-10 -54.88 -62.8 1.42 Allowed 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.533 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -60.76 -30.97 70.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.986 178.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.987 HG23 ' O ' ' A' ' 15' ' ' PHE . 54.4 t -61.76 -61.88 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.423 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 34.4 t80 -65.6 -14.86 62.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.638 178.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.522 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.27 -40.13 52.53 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.97 0.414 . . . . 0.0 110.493 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.654 ' NH1' HG22 ' A' ' 34' ' ' VAL . 37.7 mtp180 -59.12 -42.96 91.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.719 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.48 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -161.48 -145.61 0.11 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.55 179.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.12 -50.54 0.43 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.026 0.441 . . . . 0.0 111.589 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -95.29 81.27 3.6 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.943 HD12 ' CE2' ' A' ' 49' ' ' PHE . 4.4 mt -74.5 135.61 42.21 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.411 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -100.9 -178.64 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 179.967 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.416 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 1.3 m -51.13 -27.4 8.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.194 0.521 . . . . 0.0 110.439 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.79 -50.36 11.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.871 179.852 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.513 ' O ' HG23 ' A' ' 34' ' ' VAL . 5.3 mt-10 -71.02 -37.99 72.6 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.046 0.45 . . . . 0.0 109.795 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.967 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.7 pttp -60.5 -34.84 74.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.954 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.53 -35.95 15.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.625 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -75.28 -35.74 61.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.575 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.82 HG11 HG13 ' A' ' 19' ' ' VAL . 85.6 t -78.67 -37.47 20.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.102 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.722 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.47 -30.83 71.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.037 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -87.48 -19.89 27.33 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.1 OUTLIER -105.37 -23.31 12.87 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.499 -179.398 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 64.3 m -98.68 -28.27 13.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.37 21.76 5.06 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.363 -0.922 . . . . 0.0 113.454 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.908 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.14 -163.37 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.894 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.92 157.66 35.41 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.693 0.282 . . . . 0.0 111.104 -179.921 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.894 ' HD2' HG22 ' A' ' 41' ' ' THR . 77.1 Cg_exo -50.27 -25.01 12.63 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.498 2.132 . . . . 0.0 112.249 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.519 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -89.33 -30.28 18.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.588 179.607 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.908 ' HB2' HG22 ' A' ' 40' ' ' ILE . 32.8 mm-40 -80.47 -58.27 3.2 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.856 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.967 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.0 m -34.69 -41.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.841 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -71.56 -60.48 2.21 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.719 179.063 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.572 HG22 ' HA ' ' A' ' 44' ' ' GLN . 15.3 m -63.38 -44.13 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 121.264 0.554 . . . . 0.0 111.259 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.581 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -61.99 -53.64 52.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.957 -179.38 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.943 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.7 m-85 -68.59 -18.72 64.38 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 120.667 0.27 . . . . 0.0 110.858 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -62.39 -55.75 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.846 0.355 . . . . 0.0 110.379 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.449 ' N ' HG22 ' A' ' 50' ' ' ILE . 5.9 m-80 -78.14 -34.07 50.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.217 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.437 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 49.1 mmtt -77.84 -31.88 51.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.133 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 49' ' ' PHE . 8.1 ttp180 -125.36 31.89 5.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.424 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.292 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -53.46 -22.3 20.98 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 121.62 1.547 . . . . 0.0 110.961 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.794 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 27.3 mt-30 -50.09 -26.32 4.34 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.807 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -41.94 -58.38 2.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.286 0.565 . . . . 0.0 110.125 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -37.67 26.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.779 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.794 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -61.32 -56.08 24.5 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.831 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.96 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.1 -48.86 67.47 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.675 179.143 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.571 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -67.22 -30.06 69.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.201 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -55.78 -65.37 0.61 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.57 179.064 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -59.35 -28.86 67.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.371 178.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.96 HG23 ' O ' ' A' ' 15' ' ' PHE . 42.0 t -62.38 -60.26 3.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.342 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.415 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 26.9 t80 -68.94 -13.02 62.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -83.69 -35.01 24.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.903 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 46.2 mtp85 -59.46 -39.52 83.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.176 0.512 . . . . 0.0 110.313 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.495 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -158.62 -145.5 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.394 179.177 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.457 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.72 -50.6 0.41 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.078 0.466 . . . . 0.0 111.59 -179.032 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.2 t -95.63 81.25 3.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.724 -178.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.914 HD12 ' CE2' ' A' ' 49' ' ' PHE . 3.7 mt -73.42 117.13 14.8 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -93.45 175.69 6.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.647 0.261 . . . . 0.0 110.871 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.5 m -44.66 -29.85 0.82 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.997 0.427 . . . . 0.0 111.131 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.7 mmpt? -78.01 -48.6 15.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.763 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.3 mt-10 -71.14 -37.96 72.26 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.979 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 13.3 pttt -60.74 -34.14 73.98 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.65 -36.58 15.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.406 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.8 mm-40 -74.5 -35.82 63.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.487 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.829 HG11 HG13 ' A' ' 19' ' ' VAL . 75.3 t -78.33 -37.82 22.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.017 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.735 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.15 -31.16 72.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.059 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ptmt -87.47 -19.76 27.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.45 -23.55 12.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.585 0.231 . . . . 0.0 111.571 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.733 ' SG ' HG22 ' A' ' 19' ' ' VAL . 61.0 m -99.78 -25.56 14.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.482 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.23 26.9 4.13 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.304 -0.95 . . . . 0.0 113.582 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.91 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -115.48 -164.22 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.067 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.875 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.38 159.15 35.39 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.31 . . . . 0.0 111.135 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.875 ' HD2' HG22 ' A' ' 41' ' ' THR . 65.9 Cg_exo -51.27 -24.45 15.56 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.527 2.151 . . . . 0.0 112.304 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.826 ' O ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -89.73 -31.28 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.181 179.666 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.91 ' HB2' HG22 ' A' ' 40' ' ' ILE . 26.8 mm-40 -79.63 -58.15 3.33 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.802 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 23.9 m -35.14 -43.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.019 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.481 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -70.29 -59.61 2.77 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.922 179.362 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.563 HG23 ' N ' ' A' ' 48' ' ' TRP . 19.0 m -65.21 -45.22 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 121.235 0.54 . . . . 0.0 111.522 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.571 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.87 -52.74 63.76 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.001 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.914 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.4 m-85 -67.85 -25.39 65.52 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.628 0.252 . . . . 0.0 110.805 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -56.46 -53.92 34.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -79.84 -29.2 40.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.685 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.468 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 15.0 mmtt -93.0 12.64 23.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.173 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 11.6 ttp180 -174.35 34.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ttm . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 110.912 -179.881 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.681 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.2 Cg_endo -50.57 -22.47 9.26 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.553 1.502 . . . . 0.0 111.076 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.738 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 29.0 mt-30 -47.79 -25.62 1.33 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.948 179.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.41 -55.87 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 109.987 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.11 -35.73 31.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.974 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.738 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.46 -54.46 23.84 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.248 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.993 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.32 -49.25 67.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.977 179.532 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.631 HD22 ' CG ' ' A' ' 52' ' ' LYS . 0.4 OUTLIER -71.15 -33.88 70.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.914 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.681 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.3 mm-40 -49.72 -54.82 16.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.172 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -70.21 -33.86 72.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.402 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.993 HG23 ' O ' ' A' ' 15' ' ' PHE . 97.9 t -59.63 -65.42 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -60.75 -18.68 56.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.775 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.681 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.5 OUTLIER -72.61 -41.8 65.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.43 . . . . 0.0 110.358 179.654 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -61.26 -41.33 96.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.506 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -169.07 -156.78 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.24 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -134.56 -51.01 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.99 0.424 . . . . 0.0 111.607 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.6 t -84.12 78.54 9.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.52 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.909 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.8 mt -76.04 134.25 40.14 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.436 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -98.27 178.78 4.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.673 0.273 . . . . 0.0 110.416 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.403 ' HB2' ' HE2' ' A' ' 29' ' ' LYS . 3.4 m -51.23 -27.11 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.215 0.531 . . . . 0.0 110.405 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.11 -51.27 10.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.839 179.87 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.496 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.3 mt-10 -70.53 -39.1 74.24 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.834 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.983 ' O ' HG11 ' A' ' 45' ' ' VAL . 9.5 pttt -59.19 -35.24 73.23 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.72 -37.97 14.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.494 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 11.0 mm-40 -72.9 -35.09 67.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.764 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.829 HG11 HG13 ' A' ' 19' ' ' VAL . 85.0 t -79.81 -39.11 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.317 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.96 -29.85 70.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.125 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -87.31 -21.91 25.45 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 9.8 ptmt -102.72 -30.45 10.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.73 0.3 . . . . 0.0 111.396 -179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.755 ' SG ' HG22 ' A' ' 19' ' ' VAL . 75.7 m -90.42 -29.9 17.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.047 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.33 21.5 5.16 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.355 -0.926 . . . . 0.0 113.408 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.881 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -106.5 -161.96 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.879 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -152.31 155.35 33.03 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 111.119 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.879 ' HD2' HG22 ' A' ' 41' ' ' THR . 71.0 Cg_exo -48.86 -25.91 9.14 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.572 2.181 . . . . 0.0 112.306 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 4.9 tp -87.86 -28.97 21.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.593 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.881 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.8 mm-40 -82.44 -58.53 2.89 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.984 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.983 HG11 ' O ' ' A' ' 31' ' ' LYS . 24.6 m -35.9 -34.09 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.202 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.771 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -81.2 -58.8 2.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.078 179.482 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.771 HG13 ' HD3' ' A' ' 46' ' ' ARG . 20.0 m -70.11 -44.57 78.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.276 0.56 . . . . 0.0 111.448 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.562 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -60.33 -55.68 30.7 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.655 -179.595 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.909 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -61.44 -26.9 68.18 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.488 178.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.9 mm -59.62 -51.83 68.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.329 . . . . 0.0 110.485 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -80.59 -39.39 27.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.215 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.631 ' CG ' HD22 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -75.2 -21.94 58.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.225 -179.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 7.2 ttm180 -134.96 30.21 3.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.564 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.415 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.8 ttp . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 120.88 0.371 . . . . 0.0 111.033 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.669 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.177 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.669 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.3 Cg_endo -51.06 -23.97 13.47 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 121.638 1.558 . . . . 0.0 110.895 179.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.792 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 29.5 mt-30 -47.96 -27.27 2.11 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.858 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.426 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -42.92 -57.8 2.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.23 0.538 . . . . 0.0 110.04 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.446 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.86 -34.15 30.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.768 178.886 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.792 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.41 -57.5 7.27 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.998 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -53.13 -47.99 68.26 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.168 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.844 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -67.61 -39.46 84.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.812 178.675 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.639 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.7 mm-40 -45.88 -61.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.338 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -64.61 -34.22 77.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.386 179.169 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.998 HG23 ' O ' ' A' ' 15' ' ' PHE . 54.9 t -57.77 -65.9 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.108 0.48 . . . . 0.0 109.896 178.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.444 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 41.3 t80 -62.26 -15.0 44.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.711 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -81.07 -36.92 29.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.921 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.48 -37.24 77.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.074 0.464 . . . . 0.0 110.501 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -167.8 -143.95 0.05 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.494 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.499 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 29.3 mm-40 -145.82 -48.75 0.22 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.007 0.432 . . . . 0.0 111.59 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 t -83.24 71.08 10.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.342 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.0 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.7 mt -74.1 110.65 8.56 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.04 179.8 5.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.189 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.407 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 1.9 m -44.92 -30.61 1.04 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.737 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.1 mmpt? -78.25 -48.86 14.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.932 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.6 mt-10 -71.4 -37.92 71.48 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.816 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.939 ' O ' HG11 ' A' ' 45' ' ' VAL . 32.3 pttt -59.66 -34.97 73.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.049 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -90.18 -37.21 14.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.574 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.1 mm-40 -73.57 -35.3 65.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.639 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.85 HG11 HG13 ' A' ' 19' ' ' VAL . 75.8 t -79.01 -40.71 22.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.36 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.688 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -61.05 -31.25 70.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.006 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -87.63 -19.45 27.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.457 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -105.5 -23.42 12.81 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.543 -179.403 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.75 ' SG ' HG22 ' A' ' 19' ' ' VAL . 60.8 m -99.42 -28.39 13.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.274 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.55 20.39 5.45 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.709 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.889 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -106.61 -167.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 178.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.858 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -144.19 155.53 58.15 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.293 . . . . 0.0 111.119 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.858 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.6 Cg_exo -49.41 -25.92 11.1 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.702 2.268 . . . . 0.0 112.524 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.51 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -89.01 -27.1 21.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.08 0.467 . . . . 0.0 110.784 179.78 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.889 ' HB2' HG22 ' A' ' 40' ' ' ILE . 38.6 mm-40 -81.89 -58.96 2.75 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.817 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.939 HG11 ' O ' ' A' ' 31' ' ' LYS . 25.6 m -36.7 -34.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.186 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.7 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -78.71 -62.75 1.59 Allowed 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.031 179.577 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.7 HG13 ' HD3' ' A' ' 46' ' ' ARG . 11.1 m -70.27 -46.9 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 111.67 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.844 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.57 -48.41 77.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.612 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 1.0 ' CE2' HD12 ' A' ' 26' ' ' LEU . 15.9 m-30 -65.62 -31.86 73.13 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.905 179.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.695 HG12 ' O ' ' A' ' 46' ' ' ARG . 2.7 mm -49.75 -52.34 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.97 0.414 . . . . 0.0 110.566 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.37 -33.67 48.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.145 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.472 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 22.9 mmtt -95.54 22.87 6.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.168 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 49' ' ' PHE . 5.3 ttp180 -178.9 29.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.315 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.332 -0.17 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.671 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.248 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.671 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 12.4 Cg_endo -54.52 -20.85 22.16 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 121.658 1.572 . . . . 0.0 110.945 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.759 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -53.18 -23.22 7.87 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.891 179.253 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.43 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -46.06 -58.28 3.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.274 0.559 . . . . 0.0 110.114 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.78 -35.65 32.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.702 179.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.759 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.51 -51.12 62.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.405 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.913 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -56.5 -48.06 77.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.372 179.936 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.966 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -75.39 -27.34 59.05 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.177 179.344 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.523 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.1 mt-10 -54.25 -59.46 4.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -62.65 -32.16 73.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.989 178.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.913 HG23 ' O ' ' A' ' 15' ' ' PHE . 55.8 t -60.27 -59.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.411 179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.428 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 18.5 t80 -68.52 -14.01 62.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.901 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.64 -36.17 26.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.857 0.36 . . . . 0.0 110.558 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -60.84 -37.92 83.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.57 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.488 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 1.1 ptmm? -164.44 -147.91 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.372 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.488 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 27.6 mm-40 -146.34 -48.53 0.2 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.903 0.382 . . . . 0.0 111.675 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.3 t -83.18 73.64 10.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.983 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.0 OUTLIER -74.65 117.0 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.427 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -94.99 177.09 6.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.875 0.369 . . . . 0.0 110.934 -179.641 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.402 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 2.4 m -47.93 -29.14 3.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.161 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 3.4 mmpt? -78.23 -48.55 15.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.793 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.513 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.2 mt-10 -71.75 -36.83 70.55 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.946 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.976 ' O ' HG11 ' A' ' 45' ' ' VAL . 16.1 pttt -61.54 -34.55 75.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.001 0.429 . . . . 0.0 110.057 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -89.83 -36.44 15.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.505 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 7.3 mm-40 -74.72 -35.53 62.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.683 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.799 HG11 HG13 ' A' ' 19' ' ' VAL . 79.6 t -79.16 -38.92 20.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.245 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.714 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.1 -31.68 72.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.95 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -87.71 -20.21 26.55 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.486 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 1.4 pttp -105.35 -24.19 12.71 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.529 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.751 ' SG ' HG22 ' A' ' 19' ' ' VAL . 77.0 m -98.15 -27.77 14.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.228 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.77 23.85 4.19 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.16 -1.019 . . . . 0.0 113.702 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.886 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.01 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.953 0.376 . . . . 0.0 110.117 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.885 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -147.67 157.11 44.8 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.775 0.321 . . . . 0.0 111.003 179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.885 ' HD2' HG22 ' A' ' 41' ' ' THR . 65.1 Cg_exo -51.19 -23.99 14.2 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.58 2.187 . . . . 0.0 112.3 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -91.38 -28.3 17.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.1 0.476 . . . . 0.0 110.757 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.886 ' HB2' HG22 ' A' ' 40' ' ' ILE . 28.5 mm-40 -80.97 -57.0 3.73 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.976 HG11 ' O ' ' A' ' 31' ' ' LYS . 18.6 m -36.23 -36.4 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.117 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -78.14 -57.57 3.72 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.834 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.569 HG23 ' N ' ' A' ' 48' ' ' TRP . 21.0 m -68.27 -44.87 83.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.214 0.531 . . . . 0.0 111.451 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.966 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.05 -53.2 60.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.958 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.983 ' CE2' HD12 ' A' ' 26' ' ' LEU . 23.0 m-30 -66.46 -28.9 68.95 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.672 0.272 . . . . 0.0 110.521 179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -54.93 -52.74 40.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.861 0.362 . . . . 0.0 110.562 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -78.01 -29.07 49.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.159 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.765 ' HG3' HD22 ' A' ' 16' ' ' LEU . 35.5 mmtt -94.87 19.0 10.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.791 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 49' ' ' PHE . 11.1 ttp-105 -178.34 33.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.061 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 ttm . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 121.01 0.433 . . . . 0.0 110.72 -179.915 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.696 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.696 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.3 Cg_endo -50.85 -23.93 12.61 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.904 1.736 . . . . 0.0 110.949 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.79 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -50.34 -22.77 1.96 Allowed 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.083 179.047 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -48.12 -56.88 6.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.298 0.571 . . . . 0.0 109.747 178.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.425 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -81.22 -34.41 32.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.712 179.039 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.79 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.54 -48.41 69.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.411 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.969 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -58.81 -45.1 90.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.889 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.837 HD21 ' HB3' ' A' ' 52' ' ' LYS . 24.1 tp -76.13 -30.78 58.33 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.926 178.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.575 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 2.5 mt-10 -52.23 -43.45 64.31 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.83 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -81.77 -28.21 33.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.584 179.242 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.969 HG23 ' O ' ' A' ' 15' ' ' PHE . 86.6 t -67.2 -64.02 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.876 0.37 . . . . 0.0 110.388 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.457 ' CE2' ' HG3' ' A' ' 53' ' ' ARG . 11.0 t80 -60.4 -26.47 66.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.772 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -77.43 -42.63 35.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.498 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.6 mtp85 -59.74 -40.13 87.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.499 . . . . 0.0 110.194 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.479 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.22 -160.35 0.54 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.519 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 41.0 mm-40 -141.99 -46.63 0.35 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.207 0.527 . . . . 0.0 111.526 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.9 t -74.99 71.38 2.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.158 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.759 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -76.78 109.51 10.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.958 178.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 -179.15 4.65 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.403 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 9.6 t -50.74 -28.43 9.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.187 0.517 . . . . 0.0 110.347 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.445 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.01 -50.91 11.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.958 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.499 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.0 mm-40 -70.89 -38.41 73.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.032 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.991 ' O ' HG11 ' A' ' 45' ' ' VAL . 6.4 pttp -60.23 -34.68 74.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.025 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.81 -37.19 13.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.584 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.5 mm-40 -73.8 -37.34 64.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.872 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.818 HG11 HG13 ' A' ' 19' ' ' VAL . 93.3 t -78.18 -40.0 25.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.299 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.703 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -60.95 -31.74 71.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.443 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -88.06 -19.9 26.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.422 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -103.34 -25.73 13.19 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.646 -179.35 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.73 ' SG ' HG22 ' A' ' 19' ' ' VAL . 70.9 m -98.27 -28.71 13.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.139 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.73 20.69 4.89 Favored Glycine 0 C--N 1.33 0.21 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.504 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.944 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -105.77 -163.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.887 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.49 157.2 42.01 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.692 0.282 . . . . 0.0 111.074 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.887 ' HD2' HG22 ' A' ' 41' ' ' THR . 63.2 Cg_exo -51.52 -23.8 15.43 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.599 2.199 . . . . 0.0 112.281 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.493 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -90.7 -27.23 19.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.056 0.455 . . . . 0.0 110.694 179.693 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.944 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.7 mm-40 -81.5 -59.5 2.6 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.829 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.991 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.5 m -35.82 -32.96 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.445 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.512 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.77 -59.94 2.42 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.6 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.555 HG23 ' N ' ' A' ' 48' ' ' TRP . 19.9 m -67.95 -43.86 85.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.359 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.555 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.0 -54.08 46.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.042 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.759 ' CE2' HD12 ' A' ' 26' ' ' LEU . 21.6 m-30 -65.88 -24.61 66.89 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.704 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -55.49 -58.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.677 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.456 ' N ' HG22 ' A' ' 50' ' ' ILE . 73.5 m-20 -79.17 -32.4 44.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.051 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.837 ' HB3' HD21 ' A' ' 16' ' ' LEU . 13.6 mmtt -85.15 1.02 49.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.539 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -164.93 37.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.971 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.3 ttp . . . . . 0 C--N 1.328 -0.326 0 CA-C-O 120.976 0.417 . . . . 0.0 110.822 179.939 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.669 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.283 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.669 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.55 -24.25 12.24 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.607 1.538 . . . . 0.0 111.087 179.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.727 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 28.8 mt-30 -48.83 -26.85 2.63 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.579 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -44.95 -55.05 5.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.219 0.533 . . . . 0.0 110.025 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.54 -36.34 29.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.678 178.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.727 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.51 -57.44 7.31 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.515 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.972 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.73 -49.09 68.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.93 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.741 HD13 ' CE3' ' A' ' 48' ' ' TRP . 2.2 tp -68.91 -34.15 74.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.098 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -49.97 -59.53 3.79 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.159 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.31 -37.1 84.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.758 179.476 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.972 HG23 ' O ' ' A' ' 15' ' ' PHE . 93.0 t -56.12 -68.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.831 0.348 . . . . 0.0 110.085 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -16.29 15.92 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.989 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.67 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -80.0 -37.96 33.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.745 0.307 . . . . 0.0 111.223 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 -59.06 -37.33 76.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.468 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.2 ptmt -167.15 -145.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.537 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.439 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -140.68 -50.25 0.45 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.928 0.395 . . . . 0.0 111.716 -179.131 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.6 78.57 4.31 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.049 HD12 ' CE2' ' A' ' 49' ' ' PHE . 5.1 mt -72.3 124.71 25.65 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.01 176.89 5.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.756 0.312 . . . . 0.0 111.145 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.426 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 12.0 t -44.69 -31.17 1.09 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.8 mmpt? -78.66 -47.22 17.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.914 0.388 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.503 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.2 mt-10 -70.69 -38.34 73.68 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.81 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 7.1 pttt -59.95 -34.98 73.99 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -89.72 -37.38 14.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.545 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -73.05 -35.73 66.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.555 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.835 HG11 HG13 ' A' ' 19' ' ' VAL . 80.1 t -79.48 -38.16 19.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.252 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.6 -31.87 73.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.441 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -87.82 -19.6 27.24 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -26.2 13.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.661 0.267 . . . . 0.0 111.566 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.725 ' SG ' HG22 ' A' ' 19' ' ' VAL . 86.2 m -97.6 -28.44 13.94 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.299 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.42 23.33 4.48 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.35 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.877 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.8 -163.89 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.086 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.771 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.0 OUTLIER -149.18 153.02 37.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.591 0.234 . . . . 0.0 110.809 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.771 ' HD2' HG22 ' A' ' 41' ' ' THR . 5.0 Cg_endo -47.38 -26.97 6.47 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.827 2.351 . . . . 0.0 112.239 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.522 HD11 ' NE2' ' A' ' 44' ' ' GLN . 0.6 OUTLIER -84.1 -30.33 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.588 179.641 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.877 ' HB2' HG22 ' A' ' 40' ' ' ILE . 25.9 mm-40 -81.77 -57.55 3.39 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.779 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 22.8 m -36.69 -32.75 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.422 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.751 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.5 OUTLIER -83.32 -56.5 3.73 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.886 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.751 HG13 ' HD3' ' A' ' 46' ' ' ARG . 28.2 m -69.8 -42.82 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.376 0.608 . . . . 0.0 111.178 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.741 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -63.33 -55.86 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.829 -179.53 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 1.049 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.1 m-30 -64.15 -18.87 64.87 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-O 120.682 0.277 . . . . 0.0 110.588 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -64.45 -55.36 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.893 0.377 . . . . 0.0 110.388 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.404 ' N ' HG22 ' A' ' 50' ' ' ILE . 21.4 m-80 -77.72 -34.9 52.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.916 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.562 ' HG3' HD22 ' A' ' 16' ' ' LEU . 15.2 mmtt -81.47 -19.56 42.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.132 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.489 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 8.9 ttm180 -145.04 44.03 1.33 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.741 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.996 0.427 . . . . 0.0 110.48 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.678 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.293 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.678 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.7 Cg_endo -50.75 -24.38 13.13 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.936 1.757 . . . . 0.0 111.02 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.879 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 1.3 mt-30 -49.98 -26.33 4.15 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.837 179.091 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.45 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -41.7 -59.76 1.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.303 0.573 . . . . 0.0 110.058 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.438 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.32 -33.93 28.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.517 178.674 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.879 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.69 -58.19 6.96 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.344 -179.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.884 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -57.73 -45.15 86.19 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.578 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -67.59 -36.17 80.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.022 0.439 . . . . 0.0 109.963 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.8 mt-10 -50.03 -66.4 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.701 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -58.69 -34.78 71.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 15' ' ' PHE . 34.4 t -58.31 -59.08 4.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.0 0.428 . . . . 0.0 110.243 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.449 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 5.1 t80 -69.75 -12.92 62.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.144 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -84.82 -37.39 20.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.858 0.361 . . . . 0.0 110.955 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.42 -37.11 84.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.652 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.614 ' HD2' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -160.01 -164.76 1.35 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.546 179.851 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 20' ' ' PHE . 40.8 mm-40 -137.78 -20.88 1.13 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.227 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.8 t -102.89 74.33 1.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.612 HD21 ' HD3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -71.5 97.57 1.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.324 178.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.457 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -88.46 172.17 9.56 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.257 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.9 t -44.53 -31.21 1.04 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.1 mmpt? -78.18 -49.75 13.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.833 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 34' ' ' VAL . 1.9 mm-40 -68.94 -41.82 77.57 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.913 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.97 ' O ' HG11 ' A' ' 45' ' ' VAL . 6.9 pttp -57.52 -35.48 70.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.29 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.403 ' HG3' ' N ' ' A' ' 33' ' ' GLU . 7.6 pt-20 -89.04 -37.57 15.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.58 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.432 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.2 mm-40 -73.48 -35.52 65.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.602 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.803 HG11 HG13 ' A' ' 19' ' ' VAL . 81.2 t -79.42 -38.41 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.298 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.713 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.45 -35.09 78.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.456 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.12 -19.69 26.66 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.094 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -102.58 -25.47 13.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.061 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.773 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.5 m -101.64 -28.3 12.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.305 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.08 23.85 3.45 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.251 -0.976 . . . . 0.0 114.096 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.942 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.8 -163.13 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 178.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.865 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.92 154.13 34.06 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 0.0 110.945 180.0 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.865 ' HD2' HG22 ' A' ' 41' ' ' THR . 85.8 Cg_exo -47.42 -27.12 6.79 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.707 2.271 . . . . 0.0 112.382 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.559 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -88.47 -29.96 19.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.501 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.942 ' HB2' HG22 ' A' ' 40' ' ' ILE . 33.7 mm-40 -80.38 -58.75 2.98 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.775 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.97 HG11 ' O ' ' A' ' 31' ' ' LYS . 26.9 m -34.79 -40.36 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.817 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -71.54 -61.58 1.72 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.783 179.264 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.542 HG23 ' N ' ' A' ' 48' ' ' TRP . 16.8 m -64.6 -43.59 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 121.427 0.632 . . . . 0.0 111.386 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.578 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -62.88 -51.45 66.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.249 -178.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.631 ' CE1' HG11 ' A' ' 19' ' ' VAL . 22.1 m-85 -70.2 -19.64 63.16 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.895 179.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.574 HG22 ' N ' ' A' ' 51' ' ' ASN . 1.3 mm -59.63 -66.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.28 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.574 ' N ' HG22 ' A' ' 50' ' ' ILE . 31.3 m120 -66.58 -39.77 88.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.244 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.455 ' HG3' ' CE3' ' A' ' 48' ' ' TRP . 19.9 mmtt -70.02 -57.08 5.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.11 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 49' ' ' PHE . 7.7 ttm180 -98.75 32.49 2.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.634 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.405 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.0 ttp . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 120.964 0.412 . . . . 0.0 110.755 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.696 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.2 OUTLIER . . . . . 0 CA--C 1.531 0.226 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.696 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.6 Cg_endo -53.22 -21.81 18.13 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.538 1.492 . . . . 0.0 110.971 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.785 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -50.97 -22.32 2.21 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.012 179.16 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.455 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -45.3 -58.07 3.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.25 0.547 . . . . 0.0 109.975 179.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.16 -36.72 29.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.726 178.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.785 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.88 -50.48 68.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.178 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.924 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -56.46 -48.23 77.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.395 179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 1.003 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -75.22 -26.37 58.88 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.277 179.474 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -55.84 -58.92 5.83 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.49 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -63.4 -32.04 73.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.984 178.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 15' ' ' PHE . 44.4 t -57.97 -59.05 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.117 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.414 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 10.6 t80 -69.92 -12.79 61.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.409 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.539 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -83.7 -35.45 24.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.477 179.716 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -60.87 -38.56 86.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.213 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.497 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 9.6 ptmt -165.05 -149.3 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.399 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.497 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 32.8 mm-40 -144.25 -49.07 0.28 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.057 0.456 . . . . 0.0 111.749 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.6 t -77.75 68.72 3.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.651 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.947 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.7 mt -75.51 109.33 8.97 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.92 176.76 6.22 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.933 0.397 . . . . 0.0 111.235 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.3 m -45.48 -29.46 1.14 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.502 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.423 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 4.1 mmpt? -79.64 -45.32 19.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.039 0.447 . . . . 0.0 110.558 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.507 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.4 mt-10 -72.41 -35.93 68.5 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.717 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.966 ' O ' HG11 ' A' ' 45' ' ' VAL . 24.1 pttt -62.02 -34.88 77.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.944 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -89.24 -36.35 15.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.403 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.423 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -74.65 -36.46 62.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.789 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.823 HG11 HG13 ' A' ' 19' ' ' VAL . 74.9 t -78.83 -38.09 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.359 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.723 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.4 -32.03 72.8 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.67 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -88.05 -20.66 25.46 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -25.93 13.08 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.789 ' SG ' HG22 ' A' ' 19' ' ' VAL . 73.2 m -98.7 -27.48 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.63 26.32 3.41 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.03 -1.081 . . . . 0.0 113.671 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.942 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -114.02 -163.65 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.932 0.366 . . . . 0.0 110.092 179.043 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.89 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -149.91 156.9 38.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.3 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.89 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.9 Cg_exo -49.91 -24.87 11.12 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.647 2.231 . . . . 0.0 112.338 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.1 tp -89.61 -29.4 18.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.571 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.942 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.7 mm-40 -80.48 -58.62 3.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.807 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.966 HG11 ' O ' ' A' ' 31' ' ' LYS . 26.4 m -36.35 -31.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.618 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.557 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.76 -50.68 7.38 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.041 179.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.553 HG23 ' N ' ' A' ' 48' ' ' TRP . 25.5 m -75.58 -43.08 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.463 0.649 . . . . 0.0 110.732 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 1.003 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -63.21 -51.26 67.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.821 -179.618 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.947 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.2 m-30 -69.11 -18.04 63.92 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.549 0.214 . . . . 0.0 110.943 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.557 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -64.04 -59.33 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.535 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.503 ' N ' HG22 ' A' ' 50' ' ' ILE . 98.3 m-20 -75.28 -28.64 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.326 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.845 ' HG3' HD22 ' A' ' 16' ' ' LEU . 11.5 mmtp -84.57 -32.64 23.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.343 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -128.53 38.21 4.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.207 -179.608 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 ttm . . . . . 0 C--N 1.33 -0.252 0 CA-C-O 120.85 0.357 . . . . 0.0 110.831 179.748 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.68 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.308 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.68 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.7 Cg_endo -53.75 -22.42 23.1 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.581 1.521 . . . . 0.0 110.995 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.769 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -51.92 -23.69 5.31 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.851 179.162 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.438 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . . . -45.7 -57.66 4.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.29 0.567 . . . . 0.0 110.087 179.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.82 -36.07 32.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.592 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.769 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.66 -53.55 39.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.525 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.903 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.5 -46.92 76.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.581 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 1.05 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -77.78 -25.18 48.88 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.354 179.558 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.6 mm-40 -55.64 -56.2 23.15 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.27 -33.96 76.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.947 178.692 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.903 HG23 ' O ' ' A' ' 15' ' ' PHE . 41.9 t -55.18 -59.92 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.059 0.457 . . . . 0.0 109.797 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.49 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 25.1 t80 -71.06 -10.93 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.759 179.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.554 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -78.03 -42.35 32.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.073 0.463 . . . . 0.0 110.476 179.868 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.98 -45.3 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.78 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.463 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -153.15 -155.36 0.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.192 179.682 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.428 ' O ' ' CD ' ' A' ' 53' ' ' ARG . 20.2 mm-40 -140.31 -48.01 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.976 0.417 . . . . 0.0 111.456 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -82.29 78.17 8.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.457 -178.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.945 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.6 OUTLIER -80.11 125.46 29.84 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.592 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.87 -177.93 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.735 0.302 . . . . 0.0 110.551 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.421 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 4.3 t -52.79 -26.16 13.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.142 0.496 . . . . 0.0 110.548 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.99 -48.55 14.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.682 179.608 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.9 mm-40 -72.23 -36.51 69.14 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.644 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.979 ' O ' HG11 ' A' ' 45' ' ' VAL . 33.7 pttt -60.3 -35.49 75.71 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.023 0.439 . . . . 0.0 109.889 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.592 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.3 -35.82 66.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.871 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.845 HG11 HG13 ' A' ' 19' ' ' VAL . 90.4 t -79.95 -39.48 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.494 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.713 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -61.13 -31.66 71.36 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -87.48 -21.18 25.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 2.8 pttt -104.63 -26.06 12.48 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.624 -179.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.79 ' SG ' HG22 ' A' ' 19' ' ' VAL . 73.2 m -96.4 -27.49 14.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.258 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.79 21.9 4.85 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.71 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 1.006 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.26 -162.3 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.989 0.394 . . . . 0.0 110.22 179.146 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.889 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -153.57 155.41 31.5 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.624 0.249 . . . . 0.0 110.812 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.889 ' HD2' HG22 ' A' ' 41' ' ' THR . 79.0 Cg_exo -48.04 -27.09 8.5 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.593 2.195 . . . . 0.0 112.331 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.476 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 17.0 tp -89.06 -27.82 20.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 1.006 ' HB2' HG22 ' A' ' 40' ' ' ILE . 4.4 mm-40 -82.64 -57.51 3.3 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.782 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.979 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.1 m -36.12 -33.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.299 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.523 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -82.79 -53.53 5.82 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.901 179.579 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.623 HG22 ' HA ' ' A' ' 44' ' ' GLN . 19.8 m -69.9 -42.71 79.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 121.395 0.617 . . . . 0.0 110.777 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 1.05 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -64.35 -53.44 48.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.741 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.945 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.4 m-30 -67.76 -14.06 62.63 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.753 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.523 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.8 OUTLIER -67.38 -56.93 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.854 0.359 . . . . 0.0 110.379 179.817 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.485 ' N ' HG22 ' A' ' 50' ' ' ILE . 31.2 m120 -73.26 -30.6 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.047 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.93 ' HG3' HD22 ' A' ' 16' ' ' LEU . 2.3 mmtp -82.47 -42.5 18.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.851 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.49 ' HG3' ' CE1' ' A' ' 20' ' ' PHE . 16.9 ttp85 -116.77 38.43 3.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.411 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.418 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-O 120.815 0.34 . . . . 0.0 111.005 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.859 0.362 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? 61.29 104.7 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.9 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.48 -74.06 0.59 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.47 103.52 0.72 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.908 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -162.49 90.67 1.32 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.837 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.87 -46.55 1.59 Allowed 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.512 2.141 . . . . 0.0 112.271 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.2 mttm 54.92 31.29 15.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.041 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -116.03 83.1 0.33 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.352 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -146.9 93.42 2.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.857 0.361 . . . . 0.0 110.863 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 64.71 -78.59 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.073 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 52.3 p -164.08 -179.84 6.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.041 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.836 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.3 tt -112.2 168.66 4.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.895 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.646 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -54.31 -177.49 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.879 179.187 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.646 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.54 -22.87 13.46 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.565 1.51 . . . . 0.0 110.916 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.75 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 26.7 mt-30 -49.36 -25.16 2.27 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.929 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.836 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -45.24 -56.08 5.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.228 0.537 . . . . 0.0 109.91 179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.69 -36.19 28.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.679 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.75 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.73 -55.79 15.49 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.499 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.977 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.3 -52.4 63.56 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.491 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.72 HD11 ' HB3' ' A' ' 52' ' ' LYS . 1.6 tp -63.88 -34.25 77.52 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.987 178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -52.38 -65.01 0.63 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.316 179.584 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -60.73 -32.27 71.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.833 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.977 HG23 ' O ' ' A' ' 15' ' ' PHE . 89.1 t -59.03 -67.26 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.466 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 28.8 t80 -60.85 -17.53 50.69 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.981 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.564 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.67 -38.22 54.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.88 0.372 . . . . 0.0 110.68 179.744 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -59.27 -38.92 81.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.443 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.473 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -170.16 -147.57 0.06 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.804 179.805 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.8 mm-40 -140.41 -51.96 0.48 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.179 0.514 . . . . 0.0 110.983 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.5 t -77.6 70.88 4.04 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.332 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.975 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.9 mt -74.08 106.38 5.73 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.411 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 4.0 p30 -87.48 178.19 6.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.824 0.345 . . . . 0.0 111.658 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.4 m -48.07 -29.29 3.43 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.445 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.421 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.7 mmpt? -77.63 -47.5 19.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.712 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.52 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 22.6 mt-10 -73.03 -35.73 66.81 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.945 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.967 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.1 pttt -61.45 -33.87 74.46 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.029 0.442 . . . . 0.0 109.908 179.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -90.49 -36.49 14.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.442 179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.421 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.1 mm-40 -74.67 -35.57 62.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.514 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.859 HG11 HG13 ' A' ' 19' ' ' VAL . 81.9 t -78.96 -37.88 20.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.3 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.704 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.81 -30.19 71.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.098 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -87.34 -21.06 25.92 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.46 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.6 OUTLIER -103.51 -28.91 11.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.636 0.255 . . . . 0.0 111.428 -179.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.706 ' SG ' HG22 ' A' ' 19' ' ' VAL . 78.9 m -92.71 -27.84 17.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.289 -179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.92 24.29 4.95 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.428 -0.892 . . . . 0.0 113.377 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.888 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.97 -163.91 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.025 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.874 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.27 156.5 37.29 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.761 0.315 . . . . 0.0 111.148 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.874 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.1 Cg_exo -49.65 -24.9 10.27 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.687 2.258 . . . . 0.0 112.292 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.467 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.2 OUTLIER -90.0 -27.71 19.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.608 179.775 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.888 ' HB2' HG22 ' A' ' 40' ' ' ILE . 33.0 mm-40 -82.57 -58.27 2.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.843 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.967 HG11 ' O ' ' A' ' 31' ' ' LYS . 24.9 m -36.67 -32.61 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.282 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.532 ' O ' HG12 ' A' ' 50' ' ' ILE . 1.1 ptp85 -82.37 -60.57 2.16 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.891 -0.323 . . . . 0.0 110.76 179.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.543 HG23 ' N ' ' A' ' 48' ' ' TRP . 17.2 m -67.87 -44.58 85.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.329 0.585 . . . . 0.0 111.33 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.579 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.85 -52.83 63.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.797 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.975 ' CE2' HD12 ' A' ' 26' ' ' LEU . 18.2 m-30 -64.85 -28.0 69.26 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.714 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.8 mm -53.89 -51.67 42.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.66 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -80.13 -30.65 39.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.695 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.72 ' HB3' HD11 ' A' ' 16' ' ' LEU . 14.6 mmtt -94.94 18.78 11.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.103 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 49' ' ' PHE . 3.6 ttm105 -179.84 33.2 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.077 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.4 ttt -52.92 88.33 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.882 0.373 . . . . 0.0 110.851 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -80.26 -60.57 2.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.942 -179.65 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.15 -69.49 0.86 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.003 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.226 -0.892 . . . . 0.0 110.898 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.782 0.325 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.59 145.84 35.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -79.72 176.68 9.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.806 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -75.92 166.42 23.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.897 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.408 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . 1.2 t -175.78 -61.99 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.604 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.408 ' HD3' ' HB3' ' A' ' 1' ' ' SER . 73.1 Cg_endo -75.14 59.85 5.39 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.524 2.15 . . . . 0.0 112.135 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -129.67 105.67 8.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.984 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.33 30.6 58.54 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.731 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -177.38 151.85 0.8 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.833 0.349 . . . . 0.0 110.785 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.8 m -67.71 -80.92 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.77 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.8 m 47.42 -167.04 0.02 OUTLIER 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.107 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.84 HG22 ' HB2' ' A' ' 12' ' ' ALA . 5.1 tt -177.72 167.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.016 0.436 . . . . 0.0 111.07 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.662 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -55.15 -176.68 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.984 179.244 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.662 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.87 -24.45 13.67 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 121.643 1.562 . . . . 0.0 110.964 179.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.759 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 29.2 mt-30 -47.63 -27.36 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.699 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.84 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -43.38 -55.85 3.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.184 0.516 . . . . 0.0 110.038 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.66 -36.44 28.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.759 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.06 -56.01 15.52 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.643 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.956 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -56.11 -50.71 70.3 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.562 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.657 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.1 tp -65.5 -31.71 72.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.918 178.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.478 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 4.0 mt-10 -56.33 -56.15 24.68 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.393 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.466 ' HA ' ' HD3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.48 -24.39 62.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.997 179.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.956 HG23 ' O ' ' A' ' 15' ' ' PHE . 89.5 t -73.08 -64.22 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.01 0.433 . . . . 0.0 110.951 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.438 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 21.4 t80 -61.82 -17.67 57.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.902 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 1.0 OUTLIER -79.53 -38.49 34.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.518 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -59.27 -38.55 80.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.152 0.501 . . . . 0.0 110.165 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.0 ptmt -169.95 -145.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.564 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.513 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 21.5 mm-40 -144.59 -50.04 0.27 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.997 0.427 . . . . 0.0 111.412 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -81.82 71.88 8.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.417 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.988 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.5 mt -73.3 108.94 6.46 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.4 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 4.9 p30 -85.03 176.38 8.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.757 0.313 . . . . 0.0 111.06 -179.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.402 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.5 m -45.9 -29.96 1.57 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.417 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.1 mmpt? -77.65 -48.74 16.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.842 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 mt-10 -70.79 -38.82 73.37 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.892 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.974 ' O ' HG11 ' A' ' 45' ' ' VAL . 2.6 pttt -59.58 -34.33 72.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.017 0.436 . . . . 0.0 110.127 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -90.66 -37.42 13.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.633 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -73.51 -34.53 65.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.553 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.835 HG11 HG13 ' A' ' 19' ' ' VAL . 89.5 t -80.74 -38.8 17.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.402 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.693 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.4 -31.13 72.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.916 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -87.58 -19.95 27.11 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.474 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.02 -24.87 12.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.643 0.259 . . . . 0.0 111.551 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.744 ' SG ' HG22 ' A' ' 19' ' ' VAL . 74.0 m -97.5 -26.67 14.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.291 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.87 25.41 4.53 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.407 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.918 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.55 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.085 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.883 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.94 157.15 40.61 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.883 ' HD2' HG22 ' A' ' 41' ' ' THR . 78.4 Cg_exo -50.41 -24.53 12.28 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.663 2.242 . . . . 0.0 112.269 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.3 tp -89.9 -28.13 19.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.731 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.918 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.8 mm-40 -81.5 -57.98 3.23 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.126 0.488 . . . . 0.0 109.823 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.974 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.7 m -36.32 -32.82 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.615 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.506 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -83.78 -57.98 2.99 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.8 179.665 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.54 HG23 ' N ' ' A' ' 48' ' ' TRP . 21.6 m -68.66 -43.55 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 111.218 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.54 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.66 -53.91 47.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.018 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.988 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.1 m-30 -64.36 -28.9 70.01 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.427 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.2 -52.87 26.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.913 0.387 . . . . 0.0 110.599 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.2 m-20 -79.0 -30.59 44.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.638 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.657 ' HB3' HD11 ' A' ' 16' ' ' LEU . 49.7 mmtt -93.89 19.19 9.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.924 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 29.2 ttp180 -177.5 31.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.976 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.54 86.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.902 0.382 . . . . 0.0 110.877 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.9 mmp_? -71.13 -43.68 67.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.713 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.3 t -73.99 123.13 23.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.896 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.5 ttpt . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.186 -0.911 . . . . 0.0 110.953 -179.925 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 14.2 tttm . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.887 0.375 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt -132.1 38.64 3.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.983 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -154.18 104.48 2.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.874 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.84 24.92 8.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.08 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 58.97 161.67 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.929 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.96 84.16 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.598 2.198 . . . . 0.0 112.158 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.6 tttp -170.19 146.88 3.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.852 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -161.95 59.79 0.29 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.374 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.6 mttt -141.46 -58.13 0.48 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.819 0.343 . . . . 0.0 110.931 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 91.5 p -127.65 -175.18 3.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.99 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.62 -69.15 0.83 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.944 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.932 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.3 tt -115.47 165.85 10.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.164 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.682 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.97 -175.45 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.07 179.419 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.682 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.9 Cg_endo -51.95 -23.29 16.25 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.759 1.639 . . . . 0.0 111.177 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.79 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -51.2 -23.44 3.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.137 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.932 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -47.69 -57.05 6.0 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.2 0.524 . . . . 0.0 109.852 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -80.99 -34.66 32.81 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.554 178.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.79 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.16 -56.47 12.7 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.239 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.989 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.03 -51.16 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.903 179.595 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.567 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.6 tp -68.53 -31.77 71.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.309 178.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.0 mt-10 -52.47 -57.72 8.99 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.318 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -68.77 -35.99 77.75 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.899 179.647 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.989 HG23 ' O ' ' A' ' 15' ' ' PHE . 86.6 t -58.52 -64.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.148 0 CA-C-O 120.911 0.386 . . . . 0.0 110.137 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.412 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 63.2 t80 -60.72 -16.19 37.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.169 179.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.67 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -78.9 -39.21 35.57 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.993 0.425 . . . . 0.0 110.805 179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.5 mtp85 -59.54 -40.34 86.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.884 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.509 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -163.33 -147.87 0.12 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.935 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.412 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 30.2 mm-40 -139.05 -49.43 0.51 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.436 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -99.19 91.17 4.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.067 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.877 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.8 mt -78.91 136.74 37.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.101 178.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.72 175.8 6.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.243 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.1 m -51.54 -26.12 7.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.467 . . . . 0.0 110.878 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.426 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -80.01 -47.5 14.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.582 179.673 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.497 ' O ' HG23 ' A' ' 34' ' ' VAL . 2.9 mm-40 -71.63 -37.73 70.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.633 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.965 ' O ' HG11 ' A' ' 45' ' ' VAL . 11.9 pttm -60.29 -35.77 76.33 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.77 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -89.0 -36.17 15.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.701 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.426 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 8.8 mm-40 -75.18 -36.09 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.728 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.832 HG11 HG13 ' A' ' 19' ' ' VAL . 82.1 t -78.24 -39.37 24.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.01 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.716 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.09 -30.41 71.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.98 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -87.58 -20.52 26.31 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.443 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 20.2 ptmt -105.07 -26.08 12.26 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.906 -0.318 . . . . 0.0 111.466 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 70.8 m -94.79 -28.2 15.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.101 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.09 23.57 4.85 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.386 -0.912 . . . . 0.0 113.309 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.94 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.78 -162.59 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.113 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.837 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -151.8 153.95 32.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.682 0.277 . . . . 0.0 110.858 179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.837 ' HD2' HG22 ' A' ' 41' ' ' THR . 85.7 Cg_exo -47.28 -26.31 5.54 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.713 2.275 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.481 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 8.8 tp -88.05 -28.56 21.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.658 179.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.94 ' HB2' HG22 ' A' ' 40' ' ' ILE . 34.8 mm-40 -81.74 -58.14 3.13 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.068 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.965 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.3 m -36.27 -33.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.395 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.525 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -82.05 -58.75 2.83 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.792 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.551 HG23 ' N ' ' A' ' 48' ' ' TRP . 24.3 m -67.82 -43.66 86.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.271 0.558 . . . . 0.0 111.278 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.567 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.77 -54.23 45.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.018 -179.448 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.877 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -63.7 -29.34 70.58 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 120.674 0.273 . . . . 0.0 110.6 179.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.4 mm -52.28 -56.06 8.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.747 0.308 . . . . 0.0 110.912 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.405 ' N ' HG22 ' A' ' 50' ' ' ILE . 8.2 m-80 -77.76 -31.16 51.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.506 ' HB3' HD11 ' A' ' 16' ' ' LEU . 52.8 mmtt -90.11 11.63 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.133 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' A' ' 49' ' ' PHE . 9.5 ttp180 -170.57 32.35 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.165 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.51 84.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.965 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 53' ' ' ARG . 8.4 mmp_? -69.24 -41.28 77.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.993 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.8 -169.34 1.99 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.139 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.055 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 3.2 tptt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.877 0.37 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.6 36.25 1.68 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.963 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -169.78 -169.15 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.964 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 61.84 99.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.6 m -127.87 91.39 45.2 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.953 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.21 148.25 68.2 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.514 2.143 . . . . 0.0 112.298 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt 63.35 126.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.992 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.01 -79.37 0.25 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.528 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.9 83.13 7.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.896 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.9 t -150.45 135.36 17.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.87 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.7 t -75.04 145.26 42.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.946 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.854 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.9 tt -66.03 169.33 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.652 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.64 -176.9 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.96 179.261 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.652 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.6 Cg_endo -51.37 -23.9 14.87 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.684 1.589 . . . . 0.0 110.985 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.753 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 27.8 mt-30 -49.35 -26.62 3.28 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.832 179.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.854 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -44.08 -55.84 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.338 0.59 . . . . 0.0 110.038 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.402 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -81.49 -36.56 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.612 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.753 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.7 -57.53 7.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.581 -179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.962 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -54.31 -52.02 62.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.005 179.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.663 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.0 tp -64.95 -34.58 78.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.581 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.32 -64.12 0.91 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.362 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -62.75 -34.54 77.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.974 179.699 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.962 HG23 ' O ' ' A' ' 15' ' ' PHE . 74.9 t -58.58 -65.5 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-O 120.816 0.341 . . . . 0.0 110.137 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -61.34 -15.54 36.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.21 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.581 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.94 -36.27 28.19 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 120.899 0.38 . . . . 0.0 111.063 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -58.87 -37.87 77.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.587 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.451 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.0 ptmt -163.19 -138.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.331 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.436 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 19.5 mm-40 -147.9 -46.5 0.16 Allowed 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.516 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.1 t -100.36 82.92 2.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.054 HD12 ' CE2' ' A' ' 49' ' ' PHE . 5.0 mt -74.95 125.04 28.04 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 176.31 6.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.749 0.309 . . . . 0.0 110.951 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.41 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 37.1 t -45.88 -29.82 1.51 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.142 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.0 mmpt? -78.19 -48.06 16.7 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.515 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.494 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.7 mt-10 -70.1 -40.15 75.11 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.976 ' O ' HG11 ' A' ' 45' ' ' VAL . 7.3 pttt -58.76 -34.63 71.62 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.16 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -90.08 -37.01 14.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.678 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -73.88 -34.71 64.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.583 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.821 HG11 HG13 ' A' ' 19' ' ' VAL . 82.4 t -80.29 -38.07 17.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.327 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.682 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.31 -30.9 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.935 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -87.61 -19.22 28.08 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.56 -25.27 13.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.746 0.308 . . . . 0.0 111.574 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.721 ' SG ' HG22 ' A' ' 19' ' ' VAL . 56.9 m -96.99 -30.22 13.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.064 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.04 22.58 4.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.208 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.917 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -107.05 -163.26 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.87 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -149.98 155.54 37.81 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.674 0.273 . . . . 0.0 111.081 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.87 ' HD2' HG22 ' A' ' 41' ' ' THR . 73.5 Cg_exo -48.79 -29.41 14.77 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.499 2.133 . . . . 0.0 112.037 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.707 HD12 ' HD2' ' A' ' 46' ' ' ARG . 22.5 tp -84.32 -26.93 28.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.683 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.917 ' HB2' HG22 ' A' ' 40' ' ' ILE . 5.6 mm-40 -83.35 -59.19 2.54 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.976 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.6 m -36.25 -33.89 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.112 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.791 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -80.68 -58.77 2.95 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.934 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.791 HG13 ' HD3' ' A' ' 46' ' ' ARG . 21.9 m -69.0 -44.28 81.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.361 0.6 . . . . 0.0 111.344 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.565 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.45 -52.8 63.05 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.023 -179.424 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 1.054 ' CE2' HD12 ' A' ' 26' ' ' LEU . 21.6 m-30 -66.79 -24.76 66.23 Favored 'General case' 0 C--O 1.223 -0.317 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.715 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -55.51 -53.95 30.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.872 0.368 . . . . 0.0 110.369 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -80.83 -30.09 35.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.626 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.663 ' HB3' HD11 ' A' ' 16' ' ' LEU . 63.3 mmtt -93.23 14.94 16.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.021 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.551 ' O ' ' N ' ' A' ' 55' ' ' ARG . 6.5 ttp180 -178.14 36.37 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.167 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.87 69.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.051 0.453 . . . . 0.0 110.299 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.4 OUTLIER -72.47 -54.07 10.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.061 -179.498 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -84.21 171.19 12.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.947 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.843 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 14.0 tptt . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.748 0.309 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 13.4 mttt 63.5 -78.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.06 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 55.41 34.5 23.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.998 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -108.95 59.82 0.6 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.819 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.434 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -61.81 -61.82 7.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.12 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 1' ' ' SER . 27.2 Cg_endo -62.23 168.03 10.02 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.263 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt 61.99 36.38 15.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.865 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.02 -159.35 28.06 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.41 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -147.85 106.52 3.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.803 0.335 . . . . 0.0 110.862 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -117.34 -2.68 11.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.335 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 t 61.83 161.83 0.07 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.844 0.354 . . . . 0.0 110.968 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.816 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.2 tt -119.06 168.73 10.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.926 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.66 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.21 -176.74 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.973 179.167 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.66 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.1 Cg_endo -51.73 -23.08 14.72 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.678 1.585 . . . . 0.0 110.999 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.77 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 27.9 mt-30 -49.85 -25.31 3.03 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.865 179.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.816 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -44.4 -56.23 4.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.313 0.578 . . . . 0.0 109.877 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.439 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 2.6 ptt85 -81.37 -37.64 27.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.564 178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.77 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.57 -56.83 12.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.926 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -54.03 -51.45 63.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.033 179.751 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.666 HD11 ' HB3' ' A' ' 52' ' ' LYS . 1.8 tp -64.46 -34.18 77.61 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.572 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -51.4 -67.08 0.28 Allowed 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.148 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.55 -35.69 72.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.073 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.926 HG23 ' O ' ' A' ' 15' ' ' PHE . 71.8 t -56.14 -67.73 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-O 120.932 0.396 . . . . 0.0 110.018 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.41 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 46.7 t80 -61.26 -15.93 40.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.372 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.07 -37.75 28.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.861 0.363 . . . . 0.0 111.005 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.9 mtp-105 -59.99 -37.52 79.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.637 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.451 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.48 -150.35 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.318 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.41 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 32.0 mm-40 -141.68 -46.48 0.36 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.987 0.423 . . . . 0.0 111.489 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.1 t -84.55 77.85 9.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.244 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.987 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.0 mt -80.67 109.86 15.62 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -97.49 -176.12 3.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.301 . . . . 0.0 111.317 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.5 m -48.55 -30.9 5.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.42 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.4 mmpt? -77.0 -48.49 17.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.685 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.0 mm-40 -70.69 -39.15 73.66 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.984 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.974 ' O ' HG11 ' A' ' 45' ' ' VAL . 34.6 pttt -58.44 -34.44 70.83 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.089 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -91.82 -36.69 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.736 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.428 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.1 mm-40 -74.21 -35.38 63.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.646 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.847 HG11 HG13 ' A' ' 19' ' ' VAL . 91.0 t -79.97 -39.86 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.654 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.75 -30.04 71.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.099 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.41 -19.82 27.54 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.45 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -106.69 -21.74 12.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.632 0.253 . . . . 0.0 111.518 -179.467 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.743 ' SG ' HG22 ' A' ' 19' ' ' VAL . 71.6 m -99.31 -26.62 14.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.259 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 111.57 26.25 4.58 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.329 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.911 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.57 -167.92 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.262 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.855 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -143.04 155.68 62.11 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 120.827 0.346 . . . . 0.0 111.076 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.855 ' HD2' HG22 ' A' ' 41' ' ' THR . 77.8 Cg_exo -50.26 -25.13 12.81 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.616 2.211 . . . . 0.0 112.28 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.559 ' O ' HD12 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -89.22 -26.28 21.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.626 179.797 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.911 ' HB2' HG22 ' A' ' 40' ' ' ILE . 29.4 mm-40 -82.26 -58.83 2.77 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.974 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.3 m -36.62 -33.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.404 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.54 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -81.43 -59.48 2.61 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.681 179.576 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.556 HG23 ' N ' ' A' ' 48' ' ' TRP . 20.4 m -69.21 -44.32 80.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.285 0.565 . . . . 0.0 111.379 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.556 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.43 -51.99 66.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.065 -179.447 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.987 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.7 m-30 -67.05 -27.3 67.28 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.674 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -53.44 -53.88 21.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.584 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -79.92 -29.52 39.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.666 ' HB3' HD11 ' A' ' 16' ' ' LEU . 63.5 mmtt -93.57 17.41 11.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.009 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 49' ' ' PHE . 22.7 ttp180 -178.18 32.73 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.193 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.4 ttm -51.23 89.17 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.931 0.396 . . . . 0.0 111.069 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 53' ' ' ARG . 8.6 mmt180 -72.4 -50.79 23.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.823 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.53 -71.19 0.35 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.78 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.4 tttm . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.868 179.955 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.829 0.347 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.0 58.97 5.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.898 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -105.33 -35.9 7.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.908 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 2.7 pttp -97.92 38.67 1.28 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.885 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.3 p -98.3 122.4 54.04 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.812 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.45 -53.04 7.26 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.422 2.081 . . . . 0.0 112.314 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.11 -76.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.878 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.6 -115.99 5.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.445 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.6 tptp -60.28 123.71 18.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.803 0.335 . . . . 0.0 110.874 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.2 t -98.18 125.36 43.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.01 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.6 t -166.66 96.62 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.622 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.667 HG22 ' HB2' ' A' ' 12' ' ' ALA . 4.4 tt -94.83 169.75 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.427 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.684 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -60.45 -174.77 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.485 179.203 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.684 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.9 Cg_endo -49.8 -24.04 9.47 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.692 1.595 . . . . 0.0 110.998 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.774 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 28.4 mt-30 -46.46 -27.62 1.14 Allowed 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.91 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.667 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -43.25 -57.06 3.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.346 0.593 . . . . 0.0 110.074 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.413 ' O ' ' N ' ' A' ' 17' ' ' GLU . 1.2 ptm180 -81.13 -35.43 31.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.771 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.774 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.8 -56.59 11.11 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 120.985 0.421 . . . . 0.0 111.145 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.985 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -52.63 -50.09 63.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.879 179.353 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.619 HD22 ' CG ' ' A' ' 52' ' ' LYS . 0.5 OUTLIER -67.93 -36.21 79.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.801 178.825 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.625 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.7 mt-10 -48.21 -60.54 2.56 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.157 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -65.11 -35.01 79.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.264 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.985 HG23 ' O ' ' A' ' 15' ' ' PHE . 87.8 t -58.12 -65.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 110.035 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.428 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 19.3 t80 -60.72 -17.83 50.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.949 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.625 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.8 -38.87 53.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.952 0.405 . . . . 0.0 110.84 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.38 -41.79 90.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.644 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -164.23 -144.59 0.08 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.631 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.513 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 20.2 mm-40 -145.45 -48.47 0.23 Allowed 'General case' 0 C--N 1.334 -0.081 0 CA-C-O 120.881 0.372 . . . . 0.0 111.563 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.3 t -86.01 73.36 10.31 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.999 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.3 mt -73.16 113.45 10.23 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 6.5 p30 -88.2 178.13 6.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.736 0.303 . . . . 0.0 110.99 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -47.44 -28.68 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.001 0.429 . . . . 0.0 111.045 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 1.0 OUTLIER -77.1 -50.62 12.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.914 179.883 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.5 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 8.7 mt-10 -70.56 -38.9 74.19 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.82 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.992 ' O ' HG11 ' A' ' 45' ' ' VAL . 19.7 pttt -59.05 -34.89 72.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.151 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -90.5 -37.6 13.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.699 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.04 -34.28 66.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.633 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.842 HG11 HG13 ' A' ' 19' ' ' VAL . 92.7 t -81.75 -38.66 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.629 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.707 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.73 -33.72 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.992 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.8 pttm -87.58 -18.83 28.81 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 -179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.94 -25.67 13.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.667 0.27 . . . . 0.0 111.44 -179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.746 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.8 m -98.51 -29.57 13.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.138 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.28 22.96 3.97 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.415 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.899 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.08 -163.77 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 179.12 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.848 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.98 154.45 39.69 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.788 0.328 . . . . 0.0 110.984 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.848 ' HD2' HG22 ' A' ' 41' ' ' THR . 76.3 Cg_exo -47.98 -27.61 9.08 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.61 2.206 . . . . 0.0 112.289 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.454 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.1 tp -85.83 -28.3 24.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.693 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.899 ' HB2' HG22 ' A' ' 40' ' ' ILE . 37.5 mm-40 -82.06 -58.84 2.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.899 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.992 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.9 m -35.94 -33.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.375 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.691 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -82.29 -56.87 3.65 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 121.049 -0.261 . . . . 0.0 111.05 179.729 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.691 HG13 ' HD3' ' A' ' 46' ' ' ARG . 21.5 m -71.55 -43.79 71.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.254 0.55 . . . . 0.0 111.301 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.555 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.61 -55.03 35.09 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.716 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.999 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.5 m-30 -62.71 -22.52 66.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-O 120.722 0.296 . . . . 0.0 110.443 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -64.48 -52.01 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.166 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -79.82 -34.59 39.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.05 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.619 ' CG ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -80.27 -26.5 38.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.132 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.49 ' O ' ' N ' ' A' ' 55' ' ' ARG . 8.6 ttm180 -133.24 35.39 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.718 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 4.3 ttm -54.84 84.79 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.81 0.338 . . . . 0.0 110.744 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -73.15 -46.55 50.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.94 -179.563 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.61 -170.75 3.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.945 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.1 mttm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.889 -179.993 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 2.3 pttt . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.757 0.313 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -93.31 125.22 37.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -88.94 5.75 42.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.394 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 4.3 mttp 63.22 135.33 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.824 0.345 . . . . 0.0 110.936 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.412 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 2.1 t -61.51 -60.86 9.15 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.899 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 1' ' ' SER . 55.9 Cg_endo -69.59 139.89 41.93 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.454 2.103 . . . . 0.0 112.315 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -169.25 -45.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.836 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.98 150.94 21.14 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.538 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.1 pttm -107.29 -178.65 3.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.865 0.364 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.5 t 61.36 93.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.904 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 58.67 -175.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.002 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.8 HG22 ' HB2' ' A' ' 12' ' ' ALA . 5.6 tt -134.67 167.85 24.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.993 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.658 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -54.68 -177.02 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.051 179.292 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.658 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.5 Cg_endo -50.52 -24.32 12.27 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 121.821 1.681 . . . . 0.0 110.876 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.745 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 28.3 mt-30 -48.46 -25.71 1.79 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.87 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.8 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -44.63 -55.27 5.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 0.0 109.935 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -81.93 -37.11 27.27 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.861 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.745 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.83 -55.08 21.75 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.506 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.964 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.31 -51.88 65.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.014 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.695 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.8 tp -66.05 -33.56 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.638 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.7 mm-40 -51.29 -64.47 0.8 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -61.34 -36.4 80.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.481 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.964 HG23 ' O ' ' A' ' 15' ' ' PHE . 93.4 t -58.52 -66.85 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.417 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 65.6 t80 -59.51 -18.24 38.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.818 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.638 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -75.39 -39.8 58.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.982 0.42 . . . . 0.0 110.618 179.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.515 ' NH1' HG22 ' A' ' 34' ' ' VAL . 49.0 mtp180 -59.52 -40.0 85.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.706 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 14.5 ptmt -168.89 -144.75 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.427 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.513 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 7.5 mm-40 -144.58 -50.25 0.27 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.02 0.438 . . . . 0.0 111.38 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.8 t -85.83 74.39 10.2 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.986 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.9 mt -72.75 129.4 38.11 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.48 -179.65 4.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.753 0.311 . . . . 0.0 110.655 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.405 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 6.0 m -52.21 -26.94 12.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.19 0.519 . . . . 0.0 110.262 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.44 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.14 -50.23 12.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.61 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.494 ' O ' HG23 ' A' ' 34' ' ' VAL . 1.6 mt-10 -70.67 -39.37 73.6 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.815 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.3 pttp -59.0 -34.88 72.37 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.224 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -90.31 -37.85 13.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.578 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.44 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 5.0 mm-40 -73.13 -35.62 66.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.621 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.822 HG11 HG13 ' A' ' 19' ' ' VAL . 94.3 t -79.63 -38.5 19.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.163 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.694 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.32 -33.42 75.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.336 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.7 pttm -88.22 -19.95 26.17 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.411 ' CG ' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -101.91 -28.84 12.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.62 -179.111 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.741 ' SG ' HG22 ' A' ' 19' ' ' VAL . 71.4 m -95.9 -29.36 14.23 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.154 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.94 26.88 2.89 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.344 -0.932 . . . . 0.0 113.579 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.878 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -113.1 -161.91 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.053 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.773 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -149.99 151.25 31.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.495 0.188 . . . . 0.0 110.704 -179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.773 ' HD2' HG22 ' A' ' 41' ' ' THR . 4.7 Cg_endo -47.12 -27.42 6.31 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.83 2.354 . . . . 0.0 112.195 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 10.5 tp -84.81 -28.74 25.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.525 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.878 ' HB2' HG22 ' A' ' 40' ' ' ILE . 38.8 mm-40 -81.74 -58.1 3.15 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.84 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.2 m -36.2 -33.16 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.581 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.529 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -83.31 -55.85 4.09 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.831 179.662 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.552 HG23 ' N ' ' A' ' 48' ' ' TRP . 28.7 m -70.8 -44.03 76.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.344 0.593 . . . . 0.0 111.368 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.695 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.15 -53.24 58.2 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.124 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.986 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -65.48 -27.41 68.48 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-O 120.699 0.285 . . . . 0.0 110.601 179.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -54.59 -55.17 16.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.804 0.335 . . . . 0.0 110.763 -179.775 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.407 ' N ' HG22 ' A' ' 50' ' ' ILE . 49.5 m-80 -79.53 -29.97 41.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.716 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.437 ' HB3' HD11 ' A' ' 16' ' ' LEU . 23.5 mmtt -90.24 10.53 24.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.15 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.522 ' O ' ' N ' ' A' ' 55' ' ' ARG . 12.1 ttp180 -170.38 32.27 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.491 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -51.64 85.77 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.97 0.414 . . . . 0.0 110.76 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.2 mmp_? -76.41 -35.93 58.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.223 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.1 t -45.25 -54.9 6.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.419 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.9 tttp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.814 179.891 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.898 0.38 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.95 116.97 32.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.968 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 58.96 -171.3 0.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.003 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -78.83 -41.23 30.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.888 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.423 ' CB ' ' HD3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -177.38 -57.14 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.982 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.423 ' HD3' ' CB ' ' A' ' 1' ' ' SER . 84.0 Cg_exo -47.2 125.79 10.81 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.527 2.152 . . . . 0.0 112.445 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.36 78.82 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.707 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.2 133.53 8.01 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.34 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.65 126.19 30.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.818 0.342 . . . . 0.0 111.084 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.8 m -67.61 160.88 26.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.703 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.9 m -135.29 82.39 1.95 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.076 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.781 HG22 ' HB2' ' A' ' 12' ' ' ALA . 8.4 tt -159.58 165.41 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.973 0.416 . . . . 0.0 111.391 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.686 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.72 -175.48 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.082 179.408 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.686 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.4 Cg_endo -50.87 -24.42 13.58 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.846 1.697 . . . . 0.0 110.965 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.776 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 1.1 mt-30 -49.95 -23.47 2.01 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.031 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.781 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -47.19 -55.8 7.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.143 0.497 . . . . 0.0 109.948 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -81.26 -35.31 31.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.635 178.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.776 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.5 -55.29 18.7 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.168 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 1.006 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.08 -50.84 63.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.841 179.526 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.76 HD13 ' CE3' ' A' ' 48' ' ' TRP . 1.2 tp -69.14 -32.24 71.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.655 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -51.47 -56.98 10.33 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.117 179.566 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -69.38 -34.31 74.35 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.717 179.417 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 1.006 HG23 ' O ' ' A' ' 15' ' ' PHE . 90.7 t -58.54 -67.03 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-O 120.843 0.354 . . . . 0.0 110.046 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.404 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 23.8 t80 -59.1 -16.91 21.86 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.951 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.655 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.91 -40.5 47.08 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.028 0.442 . . . . 0.0 111.046 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.8 -38.82 79.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.035 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.471 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -166.27 -139.58 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.467 179.649 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.471 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 16.0 mm-40 -148.27 -46.88 0.16 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.917 0.389 . . . . 0.0 111.362 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 53' ' ' ARG . 20.8 t -93.61 78.27 4.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.328 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.06 HD12 ' CE2' ' A' ' 49' ' ' PHE . 4.5 mt -74.13 121.36 21.04 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -90.36 177.02 6.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.745 0.307 . . . . 0.0 110.879 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -48.25 -28.19 2.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.952 0.406 . . . . 0.0 111.071 179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 5.6 mmpt? -78.36 -48.4 15.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.635 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 5.2 mt-10 -70.96 -37.78 72.81 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.884 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.978 ' O ' HG11 ' A' ' 45' ' ' VAL . 35.2 pttt -60.3 -34.82 74.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.038 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -90.06 -37.45 14.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.549 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 9.6 mm-40 -73.47 -35.41 65.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.642 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.847 HG11 HG13 ' A' ' 19' ' ' VAL . 86.3 t -80.09 -37.76 17.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.295 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.683 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.5 -32.02 73.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.477 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.6 ptmt -87.7 -19.34 27.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.328 -0.396 . . . . 0.0 112.032 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.59 -27.37 12.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.624 0.249 . . . . 0.0 111.492 -179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.742 ' SG ' HG22 ' A' ' 19' ' ' VAL . 77.8 m -96.64 -29.0 14.08 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.369 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.24 24.88 4.0 Favored Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.306 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.85 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.4 -165.43 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.06 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.776 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER -146.27 151.77 44.98 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 120.573 0.225 . . . . 0.0 110.624 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.776 ' HD2' HG22 ' A' ' 41' ' ' THR . 4.8 Cg_endo -46.9 -29.1 7.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.745 2.296 . . . . 0.0 112.148 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 31.7 tp -82.42 -29.31 30.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.589 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.85 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.4 mm-40 -81.44 -58.91 2.82 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.897 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.978 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.2 m -35.89 -33.39 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.483 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.565 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.5 OUTLIER -82.56 -56.38 3.9 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.793 179.609 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.565 HG13 ' HD3' ' A' ' 46' ' ' ARG . 27.5 m -69.84 -43.3 79.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.402 0.62 . . . . 0.0 111.117 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.76 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.32 -53.78 50.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.982 -179.606 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 1.06 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.6 m-30 -66.55 -20.49 66.03 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.657 0.265 . . . . 0.0 110.741 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -59.85 -59.99 3.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.181 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.488 ' N ' HG22 ' A' ' 50' ' ' ILE . 5.5 p30 -72.94 -43.1 62.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.406 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.506 ' HG3' HD22 ' A' ' 16' ' ' LEU . 43.5 mmtt -71.18 -33.64 70.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.595 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.581 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 2.3 tmt_? -123.13 34.59 5.08 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.471 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 4.9 ttp -57.21 83.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.916 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.46 ' N ' ' O ' ' A' ' 53' ' ' ARG . 7.8 mmp_? -65.07 -40.11 94.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.646 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.84 160.86 17.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.819 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.962 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.844 0.354 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 0' ' ' LYS . 2.0 mttt -139.07 -45.59 0.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.018 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 44.67 -91.09 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.534 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' -2' ' ' LYS . 0.0 OUTLIER -95.48 -179.29 4.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.745 0.307 . . . . 0.0 110.884 179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -178.37 -61.9 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.118 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 1' ' ' SER . 16.1 Cg_endo -57.45 178.25 0.18 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.52 2.146 . . . . 0.0 112.342 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.19 94.69 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.929 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -150.8 58.34 0.44 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.529 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -130.44 140.45 50.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.778 0.323 . . . . 0.0 110.926 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 38.5 t 59.67 61.43 1.96 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.863 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 65.3 m -110.11 -25.96 9.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.08 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.688 HG22 ' HB2' ' A' ' 12' ' ' ALA . 11.3 tt -149.58 166.1 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.289 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.686 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -52.17 -175.23 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.453 179.364 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.686 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.7 Cg_endo -50.39 -25.02 13.04 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 121.78 1.654 . . . . 0.0 111.082 179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.752 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.7 OUTLIER -50.79 -23.67 2.91 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.79 179.115 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.688 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -47.89 -54.51 12.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.157 0.503 . . . . 0.0 109.814 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.96 -36.52 27.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.723 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.752 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.22 -54.06 35.11 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.574 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.959 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -58.03 -52.5 65.26 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.659 HD11 ' HB3' ' A' ' 52' ' ' LYS . 2.5 tp -63.25 -32.58 74.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.81 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.516 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -53.66 -66.59 0.37 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.097 179.332 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -27.42 66.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.051 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.959 HG23 ' O ' ' A' ' 15' ' ' PHE . 98.0 t -70.69 -63.28 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.06 0.457 . . . . 0.0 110.731 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.406 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 61.0 t80 -68.42 -11.51 59.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.544 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.516 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -85.73 -36.62 20.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.57 -179.688 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.229 0.538 . . . . 0.0 110.218 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -162.37 -143.1 0.08 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.951 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.406 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 20.1 mm-40 -147.07 -44.82 0.18 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.543 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -101.54 90.39 4.04 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.04 HD12 ' CE2' ' A' ' 49' ' ' PHE . 6.7 mt -86.0 130.54 34.51 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.421 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 3.2 p30 -95.48 -176.65 3.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.426 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 11.3 t -52.13 -29.26 21.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.043 0.449 . . . . 0.0 111.31 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.02 -47.74 17.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.6 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.517 ' O ' HG23 ' A' ' 34' ' ' VAL . 23.9 mt-10 -72.05 -36.99 69.76 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.818 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.966 ' O ' HG11 ' A' ' 45' ' ' VAL . 4.3 pttp -60.89 -34.24 74.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.02 0.438 . . . . 0.0 109.947 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -90.02 -36.39 14.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.534 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -74.94 -35.11 62.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.59 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.815 HG11 HG13 ' A' ' 19' ' ' VAL . 93.3 t -80.12 -36.78 16.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.666 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.84 -29.64 70.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.092 -0.503 . . . . 0.0 112.078 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.2 pttt -87.23 -19.92 27.66 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 5.3 ptmm? -103.93 -26.85 12.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.686 0.279 . . . . 0.0 111.513 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 61.2 m -95.21 -27.72 15.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.309 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 113.24 24.72 4.68 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.321 -0.943 . . . . 0.0 113.404 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.953 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.55 -165.36 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.163 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.882 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -146.52 158.02 47.43 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 120.769 0.318 . . . . 0.0 111.203 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.882 ' HD2' HG22 ' A' ' 41' ' ' THR . 56.6 Cg_exo -51.61 -23.76 15.79 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.647 2.231 . . . . 0.0 112.374 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 16.2 tp -91.6 -25.51 19.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.745 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.953 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.4 mm-40 -82.99 -58.54 2.82 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 109.882 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.966 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.7 m -36.53 -33.23 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.218 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.525 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.75 -59.74 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.767 179.563 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.55 HG23 ' N ' ' A' ' 48' ' ' TRP . 20.6 m -68.53 -44.06 83.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.224 0.535 . . . . 0.0 111.38 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.55 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -61.41 -54.05 48.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.962 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 1.04 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.8 m-30 -64.23 -29.61 70.71 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.458 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.525 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.5 mm -52.84 -51.68 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.908 0.385 . . . . 0.0 110.573 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 17.3 m-20 -79.63 -29.52 41.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.548 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.659 ' HB3' HD11 ' A' ' 16' ' ' LEU . 52.6 mmtt -94.84 18.36 11.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.9 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' PHE . 12.6 ttp180 -176.27 30.63 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.191 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.32 88.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.866 0.365 . . . . 0.0 110.99 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.1 mmp_? -69.1 -41.83 76.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.792 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -104.62 137.78 41.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.906 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.926 179.947 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.881 0.372 . . . . 0.0 111.184 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.83 54.5 3.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.049 0.452 . . . . 0.0 110.809 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -126.41 175.14 8.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.988 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 11.3 tptt 60.54 19.96 9.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.13 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.26 -61.67 0.38 Allowed Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.255 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.21 -44.4 1.79 Allowed 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.345 2.03 . . . . 0.0 112.424 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -58.28 130.6 47.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.88 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 140.99 -118.49 1.39 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.423 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt 61.91 -163.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.785 0.326 . . . . 0.0 110.905 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 70.67 -79.76 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.906 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 48.83 91.57 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.044 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.757 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.5 tt -59.43 168.67 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.215 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.14 -175.7 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.053 179.146 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.1 Cg_endo -52.92 -22.81 19.28 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 121.589 1.526 . . . . 0.0 111.028 179.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.81 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 28.0 mt-30 -49.76 -26.95 4.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.547 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.757 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -41.66 -59.68 1.57 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.249 0.547 . . . . 0.0 110.121 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -81.51 -35.21 30.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.701 178.842 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.81 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.2 -57.73 8.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.234 -179.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.888 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -55.35 -45.06 76.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 179.504 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.564 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -69.9 -31.69 69.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.911 179.123 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.6 OUTLIER -54.36 -64.61 0.78 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.581 179.049 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -32.33 69.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.304 178.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.888 HG23 ' O ' ' A' ' 15' ' ' PHE . 25.0 t -59.02 -57.24 12.21 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.991 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.411 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 9.0 t80 -73.41 -11.8 60.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.739 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.13 -37.4 28.91 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.504 179.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -60.24 -42.1 94.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.335 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.464 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -160.64 -155.3 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.473 179.746 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.409 ' OE1' ' CZ ' ' A' ' 20' ' ' PHE . 29.2 mm-40 -139.72 -47.99 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 111.551 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.1 t -77.9 73.77 4.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.455 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.96 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.7 OUTLIER -80.32 115.72 20.01 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 178.502 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.59 -177.26 3.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.732 0.301 . . . . 0.0 110.626 -179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.412 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 0.9 OUTLIER -52.1 -26.48 11.26 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.147 0.499 . . . . 0.0 110.604 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.418 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.54 -49.39 13.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.827 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.0 mm-40 -72.29 -36.45 68.97 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.798 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.979 ' O ' HG11 ' A' ' 45' ' ' VAL . 31.7 pttt -60.67 -34.99 75.13 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.077 0.465 . . . . 0.0 109.882 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -90.1 -35.61 15.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.69 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.8 mm-40 -75.54 -35.46 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.741 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.827 HG11 HG13 ' A' ' 19' ' ' VAL . 83.4 t -79.46 -39.49 20.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.311 179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.736 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -60.81 -34.33 74.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.753 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -87.95 -19.11 27.7 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -19.8 13.68 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.778 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.9 m -106.34 -27.15 11.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.32 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.3 21.87 4.3 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 120.124 -1.036 . . . . 0.0 114.037 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.929 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.27 -164.77 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 117.05 0.425 . . . . 0.0 110.166 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.876 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.8 156.98 41.24 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.676 0.275 . . . . 0.0 110.931 179.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.876 ' HD2' HG22 ' A' ' 41' ' ' THR . 74.1 Cg_exo -49.67 -26.87 13.79 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.62 2.213 . . . . 0.0 112.496 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 2.4 tp -88.91 -29.01 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 0.0 110.562 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.929 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.8 mm-40 -80.57 -58.23 3.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.77 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.979 HG11 ' O ' ' A' ' 31' ' ' LYS . 22.7 m -35.73 -35.03 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.508 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.537 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.2 OUTLIER -79.7 -55.39 5.04 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.667 179.526 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.566 HG23 ' N ' ' A' ' 48' ' ' TRP . 29.7 m -69.84 -44.27 79.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.457 0.646 . . . . 0.0 111.202 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.566 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -62.43 -51.49 67.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.211 -179.459 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.96 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.5 m-30 -67.57 -25.73 65.94 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.525 179.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.2 mm -56.96 -50.58 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.953 0.406 . . . . 0.0 110.375 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -80.42 -32.23 37.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.523 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt -92.95 16.1 13.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.027 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -178.15 35.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.11 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.89 79.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.954 0.407 . . . . 0.0 110.654 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.505 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.5 mmm180 -80.07 -62.02 1.81 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.815 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.55 -167.96 2.78 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.86 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.965 179.9 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 6.1 tptm . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.911 0.386 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -163.14 -66.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.949 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -96.48 102.89 14.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.938 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.5 -33.2 74.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.839 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.9 m -77.53 117.92 68.65 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.844 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -60.34 -74.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.338 2.025 . . . . 0.0 112.336 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt 57.17 37.63 28.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.934 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -139.59 -161.35 8.69 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.455 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -153.29 124.48 7.49 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.873 0.368 . . . . 0.0 110.831 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.89 113.68 14.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.918 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 t -160.53 146.27 14.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.91 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.753 HG22 ' HB2' ' A' ' 12' ' ' ALA . 12.9 tt -176.76 166.9 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.908 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.681 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -50.95 -176.61 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.414 179.282 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -52.09 -23.69 17.93 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.81 1.674 . . . . 0.0 110.952 179.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.807 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -52.12 -24.94 7.73 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.661 179.012 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.753 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -43.99 -59.22 2.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.265 0.555 . . . . 0.0 110.081 179.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -82.07 -34.97 29.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.668 178.858 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.807 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.71 -53.91 43.71 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.011 -179.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.987 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -57.0 -46.97 81.91 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.34 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.581 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -69.86 -30.03 67.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.264 179.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.522 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 3.9 mt-10 -54.88 -62.8 1.42 Allowed 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.533 179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -60.76 -30.97 70.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.986 178.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.987 HG23 ' O ' ' A' ' 15' ' ' PHE . 54.4 t -61.76 -61.88 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.423 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 34.4 t80 -65.6 -14.86 62.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.638 178.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.522 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -76.27 -40.13 52.53 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.97 0.414 . . . . 0.0 110.493 179.784 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.654 ' NH1' HG22 ' A' ' 34' ' ' VAL . 37.7 mtp180 -59.12 -42.96 91.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.719 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.48 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -161.48 -145.61 0.11 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.55 179.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.12 -50.54 0.43 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.026 0.441 . . . . 0.0 111.589 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.7 t -95.29 81.27 3.6 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.943 HD12 ' CE2' ' A' ' 49' ' ' PHE . 4.4 mt -74.5 135.61 42.21 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.411 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -100.9 -178.64 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.469 179.967 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.416 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 1.3 m -51.13 -27.4 8.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.194 0.521 . . . . 0.0 110.439 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.422 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.79 -50.36 11.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.871 179.852 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.513 ' O ' HG23 ' A' ' 34' ' ' VAL . 5.3 mt-10 -71.02 -37.99 72.6 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 121.046 0.45 . . . . 0.0 109.795 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.967 ' O ' HG11 ' A' ' 45' ' ' VAL . 3.7 pttp -60.5 -34.84 74.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.954 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.53 -35.95 15.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.625 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.0 mm-40 -75.28 -35.74 61.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.575 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.82 HG11 HG13 ' A' ' 19' ' ' VAL . 85.6 t -78.67 -37.47 20.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.102 179.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.722 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.47 -30.83 71.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.037 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -87.48 -19.89 27.33 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -178.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.1 OUTLIER -105.37 -23.31 12.87 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.499 -179.398 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.739 ' SG ' HG22 ' A' ' 19' ' ' VAL . 64.3 m -98.68 -28.27 13.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.169 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.37 21.76 5.06 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.363 -0.922 . . . . 0.0 113.454 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.908 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.14 -163.37 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.894 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.92 157.66 35.41 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.693 0.282 . . . . 0.0 111.104 -179.921 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.894 ' HD2' HG22 ' A' ' 41' ' ' THR . 77.1 Cg_exo -50.27 -25.01 12.63 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.498 2.132 . . . . 0.0 112.249 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.519 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -89.33 -30.28 18.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.588 179.607 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.908 ' HB2' HG22 ' A' ' 40' ' ' ILE . 32.8 mm-40 -80.47 -58.27 3.2 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.856 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.967 HG11 ' O ' ' A' ' 31' ' ' LYS . 21.0 m -34.69 -41.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.841 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -71.56 -60.48 2.21 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.719 179.063 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.572 HG22 ' HA ' ' A' ' 44' ' ' GLN . 15.3 m -63.38 -44.13 98.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-O 121.264 0.554 . . . . 0.0 111.259 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.581 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -61.99 -53.64 52.78 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.957 -179.38 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.943 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.7 m-85 -68.59 -18.72 64.38 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 120.667 0.27 . . . . 0.0 110.858 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -62.39 -55.75 21.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.846 0.355 . . . . 0.0 110.379 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.449 ' N ' HG22 ' A' ' 50' ' ' ILE . 5.9 m-80 -78.14 -34.07 50.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.217 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.437 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 49.1 mmtt -77.84 -31.88 51.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.133 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.477 ' O ' ' N ' ' A' ' 55' ' ' ARG . 8.1 ttp180 -125.36 31.89 5.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.424 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.5 OUTLIER -49.49 89.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 179.885 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -74.48 -43.32 56.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.79 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -61.96 -44.44 96.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.847 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.915 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.816 0.341 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -121.86 119.98 33.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.841 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.21 59.35 0.97 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.83 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -65.43 -64.07 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.785 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.3 p -158.88 143.58 11.57 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.785 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.56 -169.51 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.455 2.103 . . . . 0.0 112.333 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -128.39 87.91 2.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.852 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.88 -53.93 0.73 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.263 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.5 mttt 63.03 -80.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.793 0.33 . . . . 0.0 111.138 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 62.01 -179.71 0.13 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.848 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.3 m -84.24 179.93 7.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.908 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.799 HG22 ' HB2' ' A' ' 12' ' ' ALA . 5.8 tt -113.24 167.76 6.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.005 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.674 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.14 -175.78 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.007 179.163 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.674 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.2 Cg_endo -53.46 -22.3 20.98 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 121.62 1.547 . . . . 0.0 110.961 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.794 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 27.3 mt-30 -50.09 -26.32 4.34 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.807 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.799 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -41.94 -58.38 2.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.286 0.565 . . . . 0.0 110.125 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -37.67 26.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.779 178.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.794 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -61.32 -56.08 24.5 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.831 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.96 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.1 -48.86 67.47 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.675 179.143 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.571 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -67.22 -30.06 69.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.201 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.7 OUTLIER -55.78 -65.37 0.61 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.57 179.064 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -59.35 -28.86 67.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.371 178.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.96 HG23 ' O ' ' A' ' 15' ' ' PHE . 42.0 t -62.38 -60.26 3.02 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.342 179.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.415 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 26.9 t80 -68.94 -13.02 62.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 179.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -83.69 -35.01 24.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.903 179.973 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 46.2 mtp85 -59.46 -39.52 83.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.176 0.512 . . . . 0.0 110.313 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.495 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -158.62 -145.5 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.394 179.177 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.457 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.72 -50.6 0.41 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.078 0.466 . . . . 0.0 111.59 -179.032 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.2 t -95.63 81.25 3.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.724 -178.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.914 HD12 ' CE2' ' A' ' 49' ' ' PHE . 3.7 mt -73.42 117.13 14.8 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -93.45 175.69 6.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.647 0.261 . . . . 0.0 110.871 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.5 m -44.66 -29.85 0.82 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.997 0.427 . . . . 0.0 111.131 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.7 mmpt? -78.01 -48.6 15.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.763 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 34' ' ' VAL . 3.3 mt-10 -71.14 -37.96 72.26 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.979 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 13.3 pttt -60.74 -34.14 73.98 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -89.65 -36.58 15.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.406 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 6.8 mm-40 -74.5 -35.82 63.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.487 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.829 HG11 HG13 ' A' ' 19' ' ' VAL . 75.3 t -78.33 -37.82 22.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.017 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.735 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -65.15 -31.16 72.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.059 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ptmt -87.47 -19.76 27.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.461 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 13.3 ptmm? -105.45 -23.55 12.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.585 0.231 . . . . 0.0 111.571 -179.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.733 ' SG ' HG22 ' A' ' 19' ' ' VAL . 61.0 m -99.78 -25.56 14.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.482 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.23 26.9 4.13 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.304 -0.95 . . . . 0.0 113.582 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.91 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -115.48 -164.22 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.067 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.875 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.38 159.15 35.39 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.31 . . . . 0.0 111.135 -179.813 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.875 ' HD2' HG22 ' A' ' 41' ' ' THR . 65.9 Cg_exo -51.27 -24.45 15.56 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.527 2.151 . . . . 0.0 112.304 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.826 ' O ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -89.73 -31.28 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.181 179.666 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.91 ' HB2' HG22 ' A' ' 40' ' ' ILE . 26.8 mm-40 -79.63 -58.15 3.33 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.802 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 23.9 m -35.14 -43.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.019 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.481 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -70.29 -59.61 2.77 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.922 179.362 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.563 HG23 ' N ' ' A' ' 48' ' ' TRP . 19.0 m -65.21 -45.22 94.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 121.235 0.54 . . . . 0.0 111.522 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.571 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -60.87 -52.74 63.76 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.001 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.914 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.4 m-85 -67.85 -25.39 65.52 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 120.628 0.252 . . . . 0.0 110.805 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -56.46 -53.92 34.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.859 0.361 . . . . 0.0 110.493 179.922 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -79.84 -29.2 40.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.685 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.468 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 15.0 mmtt -93.0 12.64 23.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.173 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 49' ' ' PHE . 11.6 ttp180 -174.35 34.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.929 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ttm -55.81 85.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.936 0.398 . . . . 0.0 110.912 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.3 mmp_? -64.71 -44.45 90.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.862 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.13 -50.89 0.65 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.9 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.829 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.787 0.327 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.24 19.69 13.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.183 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 53.36 88.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.839 0.352 . . . . 0.0 111.057 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 7.5 mtmp? -91.41 136.39 33.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.9 t -136.73 65.21 53.29 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.987 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.97 113.6 1.48 Allowed 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.574 2.183 . . . . 0.0 112.192 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.59 -74.22 0.5 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.891 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.87 174.23 35.92 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.612 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.7 mmtm 62.16 63.85 1.03 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.836 0.35 . . . . 0.0 110.737 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 t 57.76 45.8 18.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.659 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -26.83 46.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.257 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.753 HG22 ' HB2' ' A' ' 12' ' ' ALA . 2.6 tt -97.43 168.19 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.013 0.435 . . . . 0.0 111.282 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.681 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -63.09 -174.98 0.11 Allowed Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.508 179.342 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.2 Cg_endo -50.57 -22.47 9.26 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.553 1.502 . . . . 0.0 111.076 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.738 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 29.0 mt-30 -47.79 -25.62 1.33 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.948 179.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.753 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -45.41 -55.87 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.261 0.553 . . . . 0.0 109.987 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.405 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.11 -35.73 31.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.974 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.738 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.46 -54.46 23.84 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.248 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.993 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.32 -49.25 67.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.977 179.532 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.631 HD22 ' CG ' ' A' ' 52' ' ' LYS . 0.4 OUTLIER -71.15 -33.88 70.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.914 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.681 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.3 mm-40 -49.72 -54.82 16.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.172 179.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -70.21 -33.86 72.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.402 179.106 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.993 HG23 ' O ' ' A' ' 15' ' ' PHE . 97.9 t -59.63 -65.42 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -60.75 -18.68 56.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.775 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.681 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.5 OUTLIER -72.61 -41.8 65.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.43 . . . . 0.0 110.358 179.654 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.7 mmt85 -61.26 -41.33 96.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.506 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.513 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -169.07 -156.78 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.24 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -134.56 -51.01 0.8 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.99 0.424 . . . . 0.0 111.607 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 22.6 t -84.12 78.54 9.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.52 -178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.909 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.8 mt -76.04 134.25 40.14 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.436 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -98.27 178.78 4.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.673 0.273 . . . . 0.0 110.416 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.403 ' HB2' ' HE2' ' A' ' 29' ' ' LYS . 3.4 m -51.23 -27.11 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.215 0.531 . . . . 0.0 110.405 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.11 -51.27 10.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.839 179.87 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.496 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.3 mt-10 -70.53 -39.1 74.24 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.834 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.983 ' O ' HG11 ' A' ' 45' ' ' VAL . 9.5 pttt -59.19 -35.24 73.23 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -89.72 -37.97 14.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.494 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 11.0 mm-40 -72.9 -35.09 67.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.764 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.829 HG11 HG13 ' A' ' 19' ' ' VAL . 85.0 t -79.81 -39.11 19.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.317 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.96 -29.85 70.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.125 -179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -87.31 -21.91 25.45 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.463 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 9.8 ptmt -102.72 -30.45 10.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.73 0.3 . . . . 0.0 111.396 -179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.755 ' SG ' HG22 ' A' ' 19' ' ' VAL . 75.7 m -90.42 -29.9 17.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.047 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.33 21.5 5.16 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.355 -0.926 . . . . 0.0 113.408 179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.881 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -106.5 -161.96 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.879 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -152.31 155.35 33.03 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.651 0.262 . . . . 0.0 111.119 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.879 ' HD2' HG22 ' A' ' 41' ' ' THR . 71.0 Cg_exo -48.86 -25.91 9.14 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.572 2.181 . . . . 0.0 112.306 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.459 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 4.9 tp -87.86 -28.97 21.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.593 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.881 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.8 mm-40 -82.44 -58.53 2.89 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.984 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.983 HG11 ' O ' ' A' ' 31' ' ' LYS . 24.6 m -35.9 -34.09 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.202 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.771 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -81.2 -58.8 2.9 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.078 179.482 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.771 HG13 ' HD3' ' A' ' 46' ' ' ARG . 20.0 m -70.11 -44.57 78.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.276 0.56 . . . . 0.0 111.448 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.562 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -60.33 -55.68 30.7 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.655 -179.595 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.909 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.8 m-30 -61.44 -26.9 68.18 Favored 'General case' 0 C--O 1.227 -0.129 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.488 178.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.9 mm -59.62 -51.83 68.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.329 . . . . 0.0 110.485 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -80.59 -39.39 27.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.215 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.631 ' CG ' HD22 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -75.2 -21.94 58.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.225 -179.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' A' ' 49' ' ' PHE . 7.2 ttm180 -134.96 30.21 3.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.564 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.415 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.8 ttp -48.39 91.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.88 0.371 . . . . 0.0 111.033 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -73.74 -41.87 61.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.936 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.5 t 38.54 55.03 1.89 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.927 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.18 -0.914 . . . . 0.0 111.017 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.846 0.355 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -138.6 140.89 39.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.987 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 59.1 109.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.981 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.92 127.23 30.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.017 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.88 165.53 5.87 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.853 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.54 149.59 84.27 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.565 2.177 . . . . 0.0 112.28 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -126.85 152.67 46.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.844 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.47 144.28 16.13 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.445 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 163.28 3.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.872 0.368 . . . . 0.0 110.866 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 m 70.26 -63.4 0.4 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.076 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 71.95 -65.03 0.37 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.822 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.812 HG22 ' HB2' ' A' ' 12' ' ' ALA . 4.4 tt -154.61 169.08 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.212 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.669 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -56.35 -176.93 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.826 179.102 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.669 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.3 Cg_endo -51.06 -23.97 13.47 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 121.638 1.558 . . . . 0.0 110.895 179.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.792 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 29.5 mt-30 -47.96 -27.27 2.11 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.858 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.812 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -42.92 -57.8 2.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.23 0.538 . . . . 0.0 110.04 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.446 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -81.86 -34.15 30.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.768 178.886 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.792 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.41 -57.5 7.27 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.053 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.998 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -53.13 -47.99 68.26 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.168 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.844 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.1 OUTLIER -67.61 -39.46 84.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.812 178.675 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.639 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.7 mm-40 -45.88 -61.79 1.58 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.338 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -64.61 -34.22 77.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.386 179.169 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.998 HG23 ' O ' ' A' ' 15' ' ' PHE . 54.9 t -57.77 -65.9 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 121.108 0.48 . . . . 0.0 109.896 178.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.444 ' CZ ' ' OE1' ' A' ' 24' ' ' GLN . 41.3 t80 -62.26 -15.0 44.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.711 179.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -81.07 -36.92 29.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.921 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.48 -37.24 77.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.074 0.464 . . . . 0.0 110.501 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -167.8 -143.95 0.05 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.494 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.499 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 29.3 mm-40 -145.82 -48.75 0.22 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.007 0.432 . . . . 0.0 111.59 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.9 t -83.24 71.08 10.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.342 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.0 HD12 ' CE2' ' A' ' 49' ' ' PHE . 2.7 mt -74.1 110.65 8.56 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.04 179.8 5.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.789 0.328 . . . . 0.0 111.189 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.407 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 1.9 m -44.92 -30.61 1.04 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.737 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 8.1 mmpt? -78.25 -48.86 14.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.932 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.502 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.6 mt-10 -71.4 -37.92 71.48 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.816 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.939 ' O ' HG11 ' A' ' 45' ' ' VAL . 32.3 pttt -59.66 -34.97 73.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.049 179.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -90.18 -37.21 14.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.574 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.1 mm-40 -73.57 -35.3 65.45 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.639 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.85 HG11 HG13 ' A' ' 19' ' ' VAL . 75.8 t -79.01 -40.71 22.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.36 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.688 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -61.05 -31.25 70.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.006 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -87.63 -19.45 27.73 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.457 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -105.5 -23.42 12.81 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.543 -179.403 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.75 ' SG ' HG22 ' A' ' 19' ' ' VAL . 60.8 m -99.42 -28.39 13.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.274 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.55 20.39 5.45 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.709 179.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.889 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -106.61 -167.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 178.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.858 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -144.19 155.53 58.15 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.293 . . . . 0.0 111.119 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.858 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.6 Cg_exo -49.41 -25.92 11.1 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.702 2.268 . . . . 0.0 112.524 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.51 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -89.01 -27.1 21.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.08 0.467 . . . . 0.0 110.784 179.78 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.889 ' HB2' HG22 ' A' ' 40' ' ' ILE . 38.6 mm-40 -81.89 -58.96 2.75 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.817 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.939 HG11 ' O ' ' A' ' 31' ' ' LYS . 25.6 m -36.7 -34.75 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.186 179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.7 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -78.71 -62.75 1.59 Allowed 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.031 179.577 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.7 HG13 ' HD3' ' A' ' 46' ' ' ARG . 11.1 m -70.27 -46.9 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 111.67 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.844 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -56.57 -48.41 77.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.612 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 1.0 ' CE2' HD12 ' A' ' 26' ' ' LEU . 15.9 m-30 -65.62 -31.86 73.13 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.905 179.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.695 HG12 ' O ' ' A' ' 46' ' ' ARG . 2.7 mm -49.75 -52.34 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.97 0.414 . . . . 0.0 110.566 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -78.37 -33.67 48.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.145 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.472 ' HG3' ' CZ3' ' A' ' 48' ' ' TRP . 22.9 mmtt -95.54 22.87 6.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.168 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 55' ' ' ARG . 5.3 ttp180 -178.9 29.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.315 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -52.29 84.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.86 0.362 . . . . 0.0 110.612 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.526 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.9 mmp_? -71.4 -49.41 42.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.078 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -136.03 173.93 11.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.4 mttp . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.868 179.986 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.765 0.317 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 60.05 -174.4 0.11 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.882 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -83.5 127.72 33.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.867 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.47 120.44 3.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.418 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.4 OUTLIER -74.37 -52.29 4.05 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.982 -179.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 1' ' ' SER . 52.4 Cg_exo -54.76 147.81 48.6 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.445 2.097 . . . . 0.0 112.199 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.8 -36.64 31.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.872 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 136.22 -22.98 3.36 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.749 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.2 tttt 59.88 65.92 1.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.904 0.383 . . . . 0.0 110.683 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 72.4 p -58.1 -38.85 77.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.054 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.3 t -84.62 70.11 10.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.869 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.978 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.0 tt -87.86 166.58 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.068 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.671 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.01 -176.51 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.01 179.14 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.671 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 12.4 Cg_endo -54.52 -20.85 22.16 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 121.658 1.572 . . . . 0.0 110.945 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.759 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -53.18 -23.22 7.87 Favored 'General case' 0 C--O 1.221 -0.416 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.891 179.253 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.978 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -46.06 -58.28 3.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.274 0.559 . . . . 0.0 110.114 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.78 -35.65 32.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.702 179.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.759 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.51 -51.12 62.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.405 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.913 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -56.5 -48.06 77.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.372 179.936 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.966 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -75.39 -27.34 59.05 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.177 179.344 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.523 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 4.1 mt-10 -54.25 -59.46 4.63 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -62.65 -32.16 73.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.989 178.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.913 HG23 ' O ' ' A' ' 15' ' ' PHE . 55.8 t -60.27 -59.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.411 179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.428 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 18.5 t80 -68.52 -14.01 62.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.901 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.64 -36.17 26.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.857 0.36 . . . . 0.0 110.558 179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -60.84 -37.92 83.74 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.57 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.488 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 1.1 ptmm? -164.44 -147.91 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.372 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.488 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 27.6 mm-40 -146.34 -48.53 0.2 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.903 0.382 . . . . 0.0 111.675 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.3 t -83.18 73.64 10.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.983 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.0 OUTLIER -74.65 117.0 15.99 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.61 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.427 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -94.99 177.09 6.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.875 0.369 . . . . 0.0 110.934 -179.641 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.402 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 2.4 m -47.93 -29.14 3.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.161 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.425 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 3.4 mmpt? -78.23 -48.55 15.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.793 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.513 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.2 mt-10 -71.75 -36.83 70.55 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.946 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.976 ' O ' HG11 ' A' ' 45' ' ' VAL . 16.1 pttt -61.54 -34.55 75.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.001 0.429 . . . . 0.0 110.057 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -89.83 -36.44 15.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.505 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.425 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 7.3 mm-40 -74.72 -35.53 62.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.683 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.799 HG11 HG13 ' A' ' 19' ' ' VAL . 79.6 t -79.16 -38.92 20.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.245 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.714 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -63.1 -31.68 72.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.95 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -87.71 -20.21 26.55 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.486 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 1.4 pttp -105.35 -24.19 12.71 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.529 -179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.751 ' SG ' HG22 ' A' ' 19' ' ' VAL . 77.0 m -98.15 -27.77 14.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.228 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.77 23.85 4.19 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.16 -1.019 . . . . 0.0 113.702 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.886 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -112.01 -164.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.953 0.376 . . . . 0.0 110.117 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.885 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -147.67 157.11 44.8 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.775 0.321 . . . . 0.0 111.003 179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.885 ' HD2' HG22 ' A' ' 41' ' ' THR . 65.1 Cg_exo -51.19 -23.99 14.2 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.58 2.187 . . . . 0.0 112.3 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -91.38 -28.3 17.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.1 0.476 . . . . 0.0 110.757 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.886 ' HB2' HG22 ' A' ' 40' ' ' ILE . 28.5 mm-40 -80.97 -57.0 3.73 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.976 HG11 ' O ' ' A' ' 31' ' ' LYS . 18.6 m -36.23 -36.4 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.117 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -78.14 -57.57 3.72 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.834 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.569 HG23 ' N ' ' A' ' 48' ' ' TRP . 21.0 m -68.27 -44.87 83.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.214 0.531 . . . . 0.0 111.451 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.966 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.05 -53.2 60.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.958 -179.517 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.983 ' CE2' HD12 ' A' ' 26' ' ' LEU . 23.0 m-30 -66.46 -28.9 68.95 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 120.672 0.272 . . . . 0.0 110.521 179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.1 mm -54.93 -52.74 40.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.861 0.362 . . . . 0.0 110.562 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -78.01 -29.07 49.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.159 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.765 ' HG3' HD22 ' A' ' 16' ' ' LEU . 35.5 mmtt -94.87 19.0 10.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.791 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 55' ' ' ARG . 11.1 ttp-105 -178.34 33.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.061 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 ttm -58.71 76.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.01 0.433 . . . . 0.0 110.72 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 53' ' ' ARG . 28.4 mmm-85 -62.26 -38.57 89.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.117 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.32 -55.44 1.1 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.322 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.153 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 3.3 pttp . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 120.758 0.313 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 14.2 mmmt -108.08 -28.38 9.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.026 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -139.72 149.22 43.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.882 0.372 . . . . 0.0 111.015 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -82.84 168.32 17.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.727 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.437 ' CB ' ' HD3' ' A' ' 2' ' ' PRO . 0.4 OUTLIER -66.23 -51.73 42.63 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.884 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.437 ' HD3' ' CB ' ' A' ' 1' ' ' SER . 9.9 Cg_exo -71.75 60.4 2.86 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.747 2.298 . . . . 0.0 112.192 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 16.7 mttt 67.37 -70.37 0.12 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.061 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.63 94.37 0.1 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.523 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -159.97 -49.7 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.798 0.332 . . . . 0.0 110.743 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 t 60.87 111.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.979 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.6 t -69.72 135.33 49.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.734 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.764 HG22 ' HB2' ' A' ' 12' ' ' ALA . 9.6 tt -98.55 165.39 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.99 0.424 . . . . 0.0 111.386 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.696 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -54.99 -175.58 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.137 179.329 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.696 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.3 Cg_endo -50.85 -23.93 12.61 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 121.904 1.736 . . . . 0.0 110.949 179.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.79 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -50.34 -22.77 1.96 Allowed 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.083 179.047 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.764 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -48.12 -56.88 6.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.298 0.571 . . . . 0.0 109.747 178.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.425 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.6 OUTLIER -81.22 -34.41 32.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.712 179.039 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.79 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.54 -48.41 69.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.411 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.969 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -58.81 -45.1 90.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.889 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.837 HD21 ' HB3' ' A' ' 52' ' ' LYS . 24.1 tp -76.13 -30.78 58.33 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.926 178.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.575 ' O ' ' HB3' ' A' ' 21' ' ' ARG . 2.5 mt-10 -52.23 -43.45 64.31 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.83 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -81.77 -28.21 33.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.584 179.242 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.969 HG23 ' O ' ' A' ' 15' ' ' PHE . 86.6 t -67.2 -64.02 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.876 0.37 . . . . 0.0 110.388 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.457 ' CE2' ' HG3' ' A' ' 53' ' ' ARG . 11.0 t80 -60.4 -26.47 66.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.772 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -77.43 -42.63 35.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.498 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 30.6 mtp85 -59.74 -40.13 87.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.147 0.499 . . . . 0.0 110.194 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.479 ' HG3' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -164.22 -160.35 0.54 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.519 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 41.0 mm-40 -141.99 -46.63 0.35 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.207 0.527 . . . . 0.0 111.526 -179.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 17.9 t -74.99 71.38 2.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.158 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.759 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.1 OUTLIER -76.78 109.51 10.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.958 178.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.58 -179.15 4.65 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.403 ' HA ' ' CD ' ' A' ' 31' ' ' LYS . 9.6 t -50.74 -28.43 9.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.187 0.517 . . . . 0.0 110.347 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.445 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.01 -50.91 11.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.958 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.499 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 4.0 mm-40 -70.89 -38.41 73.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.032 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.991 ' O ' HG11 ' A' ' 45' ' ' VAL . 6.4 pttp -60.23 -34.68 74.02 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.025 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -90.81 -37.19 13.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.584 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.5 mm-40 -73.8 -37.34 64.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.872 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.818 HG11 HG13 ' A' ' 19' ' ' VAL . 93.3 t -78.18 -40.0 25.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.299 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.703 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -60.95 -31.74 71.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.443 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -88.06 -19.9 26.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.422 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 0.0 OUTLIER -103.34 -25.73 13.19 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.646 -179.35 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.73 ' SG ' HG22 ' A' ' 19' ' ' VAL . 70.9 m -98.27 -28.71 13.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.139 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 116.73 20.69 4.89 Favored Glycine 0 C--N 1.33 0.21 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.504 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.944 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.1 OUTLIER -105.77 -163.39 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.887 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -148.49 157.2 42.01 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.692 0.282 . . . . 0.0 111.074 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.887 ' HD2' HG22 ' A' ' 41' ' ' THR . 63.2 Cg_exo -51.52 -23.8 15.43 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.599 2.199 . . . . 0.0 112.281 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.493 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -90.7 -27.23 19.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.056 0.455 . . . . 0.0 110.694 179.693 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.944 ' HB2' HG22 ' A' ' 40' ' ' ILE . 35.7 mm-40 -81.5 -59.5 2.6 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.829 179.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.991 HG11 ' O ' ' A' ' 31' ' ' LYS . 20.5 m -35.82 -32.96 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.445 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.512 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -81.77 -59.94 2.42 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.6 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.555 HG23 ' N ' ' A' ' 48' ' ' TRP . 19.9 m -67.95 -43.86 85.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.359 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.555 ' N ' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.0 -54.08 46.58 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.042 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.759 ' CE2' HD12 ' A' ' 26' ' ' LEU . 21.6 m-30 -65.88 -24.61 66.89 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.704 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -55.49 -58.24 5.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.833 0.349 . . . . 0.0 110.677 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.456 ' N ' HG22 ' A' ' 50' ' ' ILE . 73.5 m-20 -79.17 -32.4 44.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.051 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.837 ' HB3' HD21 ' A' ' 16' ' ' LEU . 13.6 mmtt -85.15 1.02 49.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.539 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -164.93 37.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.971 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.3 ttp -62.25 73.96 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.976 0.417 . . . . 0.0 110.822 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' A' ' 53' ' ' ARG . 44.7 mmm-85 -68.55 -43.18 77.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.778 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.5 t -55.81 132.67 49.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.03 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.866 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 9.8 mmmt . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.814 0.34 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -39.94 87.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.892 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -175.8 -69.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.94 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 2.9 mtpm? -98.89 175.63 5.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.941 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.4 t 60.37 63.66 2.83 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.903 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -51.4 -35.22 53.78 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.56 2.173 . . . . 0.0 112.4 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -149.47 166.42 29.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.002 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.02 166.27 29.75 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.458 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.4 ' O ' ' N ' ' A' ' 7' ' ' SER . 7.8 mmtt 60.82 84.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.8 0.333 . . . . 0.0 110.799 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.53 -82.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.989 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 5' ' ' LYS . 0.4 OUTLIER 171.14 -70.91 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.827 0.346 . . . . 0.0 110.901 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.731 HG22 ' HB2' ' A' ' 12' ' ' ALA . 8.5 tt -93.24 169.39 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.064 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.669 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.92 -175.67 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.02 179.293 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.669 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 9.4 Cg_endo -50.55 -24.25 12.24 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.607 1.538 . . . . 0.0 111.087 179.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.727 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 28.8 mt-30 -48.83 -26.85 2.63 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.579 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.731 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -44.95 -55.05 5.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.219 0.533 . . . . 0.0 110.025 179.33 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.54 -36.34 29.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.678 178.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.727 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -66.51 -57.44 7.31 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.515 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.972 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -53.73 -49.09 68.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.93 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.741 HD13 ' CE3' ' A' ' 48' ' ' TRP . 2.2 tp -68.91 -34.15 74.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.098 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.67 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -49.97 -59.53 3.79 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.159 179.557 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.31 -37.1 84.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.758 179.476 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.972 HG23 ' O ' ' A' ' 15' ' ' PHE . 93.0 t -56.12 -68.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.831 0.348 . . . . 0.0 110.085 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -58.72 -16.29 15.92 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.989 179.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.67 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -80.0 -37.96 33.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.745 0.307 . . . . 0.0 111.223 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 -59.06 -37.33 76.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.468 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 14.2 ptmt -167.15 -145.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.537 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.439 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -140.68 -50.25 0.45 Allowed 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 120.928 0.395 . . . . 0.0 111.716 -179.131 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.8 t -93.6 78.57 4.31 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.049 HD12 ' CE2' ' A' ' 49' ' ' PHE . 5.1 mt -72.3 124.71 25.65 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 178.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.01 176.89 5.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.756 0.312 . . . . 0.0 111.145 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.426 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 12.0 t -44.69 -31.17 1.09 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 7.8 mmpt? -78.66 -47.22 17.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.914 0.388 . . . . 0.0 110.806 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.503 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 6.2 mt-10 -70.69 -38.34 73.68 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.81 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.988 ' O ' HG11 ' A' ' 45' ' ' VAL . 7.1 pttt -59.95 -34.98 73.99 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -89.72 -37.38 14.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.545 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -73.05 -35.73 66.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.555 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.835 HG11 HG13 ' A' ' 19' ' ' VAL . 80.1 t -79.48 -38.16 19.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.252 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -64.6 -31.87 73.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.441 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.7 pttm -87.82 -19.6 27.24 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -26.2 13.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.661 0.267 . . . . 0.0 111.566 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.725 ' SG ' HG22 ' A' ' 19' ' ' VAL . 86.2 m -97.6 -28.44 13.94 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.299 -179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.42 23.33 4.48 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.35 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.877 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.8 -163.89 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.086 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.771 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.0 OUTLIER -149.18 153.02 37.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.591 0.234 . . . . 0.0 110.809 179.999 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.771 ' HD2' HG22 ' A' ' 41' ' ' THR . 5.0 Cg_endo -47.38 -26.97 6.47 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.827 2.351 . . . . 0.0 112.239 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.522 HD11 ' NE2' ' A' ' 44' ' ' GLN . 0.6 OUTLIER -84.1 -30.33 26.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.588 179.641 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.877 ' HB2' HG22 ' A' ' 40' ' ' ILE . 25.9 mm-40 -81.77 -57.55 3.39 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.779 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.988 HG11 ' O ' ' A' ' 31' ' ' LYS . 22.8 m -36.69 -32.75 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.422 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.751 ' HD3' HG13 ' A' ' 47' ' ' VAL . 0.5 OUTLIER -83.32 -56.5 3.73 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.886 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.751 HG13 ' HD3' ' A' ' 46' ' ' ARG . 28.2 m -69.8 -42.82 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.376 0.608 . . . . 0.0 111.178 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.741 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -63.33 -55.86 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.829 -179.53 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 1.049 ' CE2' HD12 ' A' ' 26' ' ' LEU . 20.1 m-30 -64.15 -18.87 64.87 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-O 120.682 0.277 . . . . 0.0 110.588 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 46' ' ' ARG . 1.0 OUTLIER -64.45 -55.36 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.893 0.377 . . . . 0.0 110.388 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.404 ' N ' HG22 ' A' ' 50' ' ' ILE . 21.4 m-80 -77.72 -34.9 52.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.916 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.562 ' HG3' HD22 ' A' ' 16' ' ' LEU . 15.2 mmtt -81.47 -19.56 42.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.132 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 55' ' ' ARG . 8.9 ttm180 -145.04 44.03 1.33 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.741 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.49 68.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.996 0.427 . . . . 0.0 110.48 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 53' ' ' ARG . 5.9 mmp_? -73.57 -57.81 3.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.962 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t 36.4 -89.34 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.365 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.815 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.911 0.386 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm 60.33 33.92 20.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.957 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -158.92 -72.05 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.967 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm 60.65 104.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.83 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.414 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -178.88 -61.24 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.11 -179.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 1' ' ' SER . 46.2 Cg_endo -67.71 -165.69 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.429 2.086 . . . . 0.0 112.295 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 68.53 90.45 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.936 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 73.7 155.8 3.81 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.742 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.57 157.24 47.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.823 0.344 . . . . 0.0 110.875 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.8 p 58.03 46.19 16.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.878 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.1 t -62.93 165.52 6.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.829 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.726 HG22 ' HB2' ' A' ' 12' ' ' ALA . 6.3 tt -62.23 166.68 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.087 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.678 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -53.42 -176.48 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.105 179.271 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.678 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 10.7 Cg_endo -50.75 -24.38 13.13 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 121.936 1.757 . . . . 0.0 111.02 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.879 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 1.3 mt-30 -49.98 -26.33 4.15 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.837 179.091 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.726 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -41.7 -59.76 1.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.303 0.573 . . . . 0.0 110.058 179.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.438 ' O ' ' N ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -82.32 -33.93 28.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.517 178.674 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.879 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -64.69 -58.19 6.96 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.344 -179.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.884 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -57.73 -45.15 86.19 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.545 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.578 HD23 ' CE3' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -67.59 -36.17 80.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.022 0.439 . . . . 0.0 109.963 179.176 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 2.8 mt-10 -50.03 -66.4 0.4 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.701 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -58.69 -34.78 71.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.884 HG23 ' O ' ' A' ' 15' ' ' PHE . 34.4 t -58.31 -59.08 4.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 121.0 0.428 . . . . 0.0 110.243 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.449 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 5.1 t80 -69.75 -12.92 62.0 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.144 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -84.82 -37.39 20.8 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.858 0.361 . . . . 0.0 110.955 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -62.42 -37.11 84.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.652 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.614 ' HD2' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -160.01 -164.76 1.35 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.546 179.851 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 20' ' ' PHE . 40.8 mm-40 -137.78 -20.88 1.13 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.227 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.8 t -102.89 74.33 1.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.612 HD21 ' HD3' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -71.5 97.57 1.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.324 178.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.457 ' ND2' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -88.46 172.17 9.56 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.257 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.9 t -44.53 -31.21 1.04 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 6.1 mmpt? -78.18 -49.75 13.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.833 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 34' ' ' VAL . 1.9 mm-40 -68.94 -41.82 77.57 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.913 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.97 ' O ' HG11 ' A' ' 45' ' ' VAL . 6.9 pttp -57.52 -35.48 70.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.29 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.403 ' HG3' ' N ' ' A' ' 33' ' ' GLU . 7.6 pt-20 -89.04 -37.57 15.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.58 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.432 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 10.2 mm-40 -73.48 -35.52 65.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.602 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.803 HG11 HG13 ' A' ' 19' ' ' VAL . 81.2 t -79.42 -38.41 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.298 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.713 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.45 -35.09 78.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.456 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.12 -19.69 26.66 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.094 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -102.58 -25.47 13.57 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.061 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.773 ' SG ' HG22 ' A' ' 19' ' ' VAL . 76.5 m -101.64 -28.3 12.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.305 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.08 23.85 3.45 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.251 -0.976 . . . . 0.0 114.096 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.942 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -110.8 -163.13 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 178.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.865 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -150.92 154.13 34.06 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.79 0.329 . . . . 0.0 110.945 180.0 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.865 ' HD2' HG22 ' A' ' 41' ' ' THR . 85.8 Cg_exo -47.42 -27.12 6.79 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.707 2.271 . . . . 0.0 112.382 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.559 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -88.47 -29.96 19.76 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.501 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.942 ' HB2' HG22 ' A' ' 40' ' ' ILE . 33.7 mm-40 -80.38 -58.75 2.98 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.775 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.97 HG11 ' O ' ' A' ' 31' ' ' LYS . 26.9 m -34.79 -40.36 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.817 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -71.54 -61.58 1.72 Allowed 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.783 179.264 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.542 HG23 ' N ' ' A' ' 48' ' ' TRP . 16.8 m -64.6 -43.59 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 121.427 0.632 . . . . 0.0 111.386 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.578 ' CE3' HD23 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -62.88 -51.45 66.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.249 -178.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.631 ' CE1' HG11 ' A' ' 19' ' ' VAL . 22.1 m-85 -70.2 -19.64 63.16 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.895 179.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.574 HG22 ' N ' ' A' ' 51' ' ' ASN . 1.3 mm -59.63 -66.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 110.28 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.574 ' N ' HG22 ' A' ' 50' ' ' ILE . 31.3 m120 -66.58 -39.77 88.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.244 179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.455 ' HG3' ' CE3' ' A' ' 48' ' ' TRP . 19.9 mmtt -70.02 -57.08 5.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.008 0.432 . . . . 0.0 111.11 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.498 ' O ' ' N ' ' A' ' 55' ' ' ARG . 7.7 ttm180 -98.75 32.49 2.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.634 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.405 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 2.0 ttp -51.87 86.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.964 0.412 . . . . 0.0 110.755 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 53' ' ' ARG . 1.7 mmp_? -73.44 -38.32 65.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.062 -179.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -136.51 -168.02 2.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.044 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.9 mptt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.89 179.962 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.831 0.348 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 5.1 tttp 58.27 84.07 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.906 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -131.47 -60.78 0.93 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.85 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -127.34 -41.15 1.76 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.066 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.93 153.31 0.14 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.923 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.38 64.73 2.84 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.525 2.15 . . . . 0.0 112.437 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -112.14 -36.0 5.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.76 -79.44 1.16 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.386 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.84 73.74 0.47 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.848 0.356 . . . . 0.0 110.948 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.1 m -72.43 -56.16 5.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.887 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.5 m -160.84 139.12 9.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.63 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.663 HG22 ' HB2' ' A' ' 12' ' ' ALA . 8.9 tt -108.46 163.89 5.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.024 0.44 . . . . 0.0 111.404 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.696 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.2 OUTLIER -55.65 -174.08 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.917 179.191 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.696 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.6 Cg_endo -53.22 -21.81 18.13 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.538 1.492 . . . . 0.0 110.971 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.785 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -50.97 -22.32 2.21 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.012 179.16 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.663 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -45.3 -58.07 3.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.25 0.547 . . . . 0.0 109.975 179.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.16 -36.72 29.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.726 178.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.785 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -63.88 -50.48 68.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.178 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.924 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.2 OUTLIER -56.46 -48.23 77.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.395 179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 1.003 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.3 OUTLIER -75.22 -26.37 58.88 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.277 179.474 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -55.84 -58.92 5.83 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 178.49 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -63.4 -32.04 73.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.984 178.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 15' ' ' PHE . 44.4 t -57.97 -59.05 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.117 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.414 ' O ' ' CD1' ' A' ' 20' ' ' PHE . 10.6 t80 -69.92 -12.79 61.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.409 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.539 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -83.7 -35.45 24.47 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.477 179.716 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.2 mtp-105 -60.87 -38.56 86.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.213 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.497 ' HG3' ' N ' ' A' ' 24' ' ' GLN . 9.6 ptmt -165.05 -149.3 0.12 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.399 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.497 ' N ' ' HG3' ' A' ' 23' ' ' LYS . 32.8 mm-40 -144.25 -49.07 0.28 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.057 0.456 . . . . 0.0 111.749 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.6 t -77.75 68.72 3.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.651 -178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.947 HD12 ' CE2' ' A' ' 49' ' ' PHE . 1.7 mt -75.51 109.33 8.97 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.92 176.76 6.22 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.933 0.397 . . . . 0.0 111.235 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 1.3 m -45.48 -29.46 1.14 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.502 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.423 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 4.1 mmpt? -79.64 -45.32 19.3 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.039 0.447 . . . . 0.0 110.558 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.4 mt-10 -72.41 -35.93 68.5 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.717 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.966 ' O ' HG11 ' A' ' 45' ' ' VAL . 24.1 pttt -62.02 -34.88 77.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.944 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -89.24 -36.35 15.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.403 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.423 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 3.7 mm-40 -74.65 -36.46 62.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.789 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.823 HG11 HG13 ' A' ' 19' ' ' VAL . 74.9 t -78.83 -38.09 20.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.359 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.723 ' HB1' ' C ' ' A' ' 40' ' ' ILE . . . -62.4 -32.03 72.8 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.67 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -88.05 -20.66 25.46 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -25.93 13.08 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.789 ' SG ' HG22 ' A' ' 19' ' ' VAL . 73.2 m -98.7 -27.48 13.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.428 -179.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.63 26.32 3.41 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.03 -1.081 . . . . 0.0 113.671 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.942 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -114.02 -163.65 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.932 0.366 . . . . 0.0 110.092 179.043 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.89 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -149.91 156.9 38.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.3 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.89 ' HD2' HG22 ' A' ' 41' ' ' THR . 75.9 Cg_exo -49.91 -24.87 11.12 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.647 2.231 . . . . 0.0 112.338 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.49 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 1.1 tp -89.61 -29.4 18.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.571 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.942 ' HB2' HG22 ' A' ' 40' ' ' ILE . 36.7 mm-40 -80.48 -58.62 3.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.807 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.966 HG11 ' O ' ' A' ' 31' ' ' LYS . 26.4 m -36.35 -31.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.618 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.557 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.0 OUTLIER -84.76 -50.68 7.38 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.041 179.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.553 HG23 ' N ' ' A' ' 48' ' ' TRP . 25.5 m -75.58 -43.08 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.463 0.649 . . . . 0.0 110.732 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 1.003 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.1 OUTLIER -63.21 -51.26 67.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.821 -179.618 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.947 ' CE2' HD12 ' A' ' 26' ' ' LEU . 22.2 m-30 -69.11 -18.04 63.92 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.549 0.214 . . . . 0.0 110.943 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.557 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -64.04 -59.33 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.535 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.503 ' N ' HG22 ' A' ' 50' ' ' ILE . 98.3 m-20 -75.28 -28.64 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.326 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.845 ' HG3' HD22 ' A' ' 16' ' ' LEU . 11.5 mmtp -84.57 -32.64 23.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.343 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -128.53 38.21 4.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.207 -179.608 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 ttm -55.84 85.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.85 0.357 . . . . 0.0 110.831 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 53' ' ' ARG . 2.1 mmp_? -86.09 -51.46 6.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.958 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -54.08 105.07 0.12 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.135 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.9 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.82 0.343 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 5.4 tttp -78.87 124.86 28.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.917 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 43.21 94.1 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.473 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -28.8 28.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.359 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.45 ' CB ' ' HD3' ' A' ' 2' ' ' PRO . 0.3 OUTLIER -52.73 -53.6 52.52 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.094 -179.703 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.45 ' HD3' ' CB ' ' A' ' 1' ' ' SER . 23.4 Cg_exo -64.26 -25.64 64.59 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.505 2.137 . . . . 0.0 112.073 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.75 79.73 0.25 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.771 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 128.65 -113.62 1.62 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.438 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.41 68.3 0.09 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.17 -169.39 2.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.953 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 m 61.94 115.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.852 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.824 HG22 ' HB2' ' A' ' 12' ' ' ALA . 8.6 tt -137.01 167.57 23.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.083 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.68 ' CB ' ' HD2' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -52.86 -175.46 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.211 179.325 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.68 ' HD2' ' CB ' ' A' ' 9' ' ' SER . 11.7 Cg_endo -53.75 -22.42 23.1 Favored 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.581 1.521 . . . . 0.0 110.995 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.769 ' HA ' ' HB3' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -51.92 -23.69 5.31 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.851 179.162 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.824 ' HB2' HG22 ' A' ' 8' ' ' ILE . . . -45.7 -57.66 4.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.29 0.567 . . . . 0.0 110.087 179.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.82 -36.07 32.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.592 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.769 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . . . -65.66 -53.55 39.71 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.525 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.903 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.1 OUTLIER -55.5 -46.92 76.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.581 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 1.05 HD13 ' CE3' ' A' ' 48' ' ' TRP . 0.2 OUTLIER -77.78 -25.18 48.88 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.354 179.558 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 1.6 mm-40 -55.64 -56.2 23.15 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -66.27 -33.96 76.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.947 178.692 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.903 HG23 ' O ' ' A' ' 15' ' ' PHE . 41.9 t -55.18 -59.92 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.15 0 CA-C-O 121.059 0.457 . . . . 0.0 109.797 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.49 ' CE1' ' HG3' ' A' ' 53' ' ' ARG . 25.1 t80 -71.06 -10.93 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.759 179.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.554 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -78.03 -42.35 32.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.073 0.463 . . . . 0.0 110.476 179.868 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.98 -45.3 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.78 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.463 ' CG ' ' CD2' ' A' ' 26' ' ' LEU . 0.1 OUTLIER -153.15 -155.36 0.6 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.192 179.682 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.428 ' O ' ' CD ' ' A' ' 53' ' ' ARG . 20.2 mm-40 -140.31 -48.01 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.976 0.417 . . . . 0.0 111.456 -179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.1 t -82.29 78.17 8.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.457 -178.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.945 HD12 ' CE2' ' A' ' 49' ' ' PHE . 0.6 OUTLIER -80.11 125.46 29.84 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.592 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.87 -177.93 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.735 0.302 . . . . 0.0 110.551 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.421 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 4.3 t -52.79 -26.16 13.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.142 0.496 . . . . 0.0 110.548 179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -78.99 -48.55 14.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.682 179.608 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HB ' ' A' ' 34' ' ' VAL . 3.9 mm-40 -72.23 -36.51 69.14 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.644 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.979 ' O ' HG11 ' A' ' 45' ' ' VAL . 33.7 pttt -60.3 -35.49 75.71 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.023 0.439 . . . . 0.0 109.889 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -89.32 -37.82 14.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.592 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' CG ' ' O ' ' A' ' 29' ' ' LYS . 4.0 mm-40 -73.3 -35.82 66.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.871 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.845 HG11 HG13 ' A' ' 19' ' ' VAL . 90.4 t -79.95 -39.48 19.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.494 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.713 ' HA ' HG13 ' A' ' 40' ' ' ILE . . . -61.13 -31.66 71.36 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -87.48 -21.18 25.66 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 34' ' ' VAL . 2.8 pttt -104.63 -26.06 12.48 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.624 -179.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.79 ' SG ' HG22 ' A' ' 19' ' ' VAL . 73.2 m -96.4 -27.49 14.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.258 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.79 21.9 4.85 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.132 -1.032 . . . . 0.0 113.71 179.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 1.006 HG22 ' HB2' ' A' ' 44' ' ' GLN . 0.0 OUTLIER -109.26 -162.3 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.989 0.394 . . . . 0.0 110.22 179.146 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.889 HG22 ' HD2' ' A' ' 42' ' ' PRO . 0.2 OUTLIER -153.57 155.41 31.5 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.624 0.249 . . . . 0.0 110.812 -179.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.889 ' HD2' HG22 ' A' ' 41' ' ' THR . 79.0 Cg_exo -48.04 -27.09 8.5 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.593 2.195 . . . . 0.0 112.331 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.476 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 17.0 tp -89.06 -27.82 20.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.576 179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 1.006 ' HB2' HG22 ' A' ' 40' ' ' ILE . 4.4 mm-40 -82.64 -57.51 3.3 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.782 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.979 HG11 ' O ' ' A' ' 31' ' ' LYS . 19.1 m -36.12 -33.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.874 -0.603 . . . . 0.0 112.299 179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.523 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -82.79 -53.53 5.82 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.044 -0.262 . . . . 0.0 110.901 179.579 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.623 HG22 ' HA ' ' A' ' 44' ' ' GLN . 19.8 m -69.9 -42.71 79.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 121.395 0.617 . . . . 0.0 110.777 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 1.05 ' CE3' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -64.35 -53.44 48.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.741 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.945 ' CE2' HD12 ' A' ' 26' ' ' LEU . 19.4 m-30 -67.76 -14.06 62.63 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.753 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.523 HG12 ' O ' ' A' ' 46' ' ' ARG . 0.8 OUTLIER -67.38 -56.93 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.854 0.359 . . . . 0.0 110.379 179.817 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.485 ' N ' HG22 ' A' ' 50' ' ' ILE . 31.2 m120 -73.26 -30.6 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.047 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.93 ' HG3' HD22 ' A' ' 16' ' ' LEU . 2.3 mmtp -82.47 -42.5 18.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.851 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.49 ' HG3' ' CE1' ' A' ' 20' ' ' PHE . 16.9 ttp85 -116.77 38.43 3.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.411 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.418 ' CA ' ' O ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -55.01 85.17 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.815 0.34 . . . . 0.0 111.005 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 53' ' ' ARG . 0.5 OUTLIER -89.65 -61.97 1.58 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.709 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.4 t -109.09 85.89 2.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.754 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.5 pttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.15 -0.929 . . . . 0.0 111.48 -179.974 . . . . . . . . 0 0 . 1 stop_ save_