data_2lsw_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 2lsw _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo . . . . . 0 N--CA 1.484 0.915 0 CA-C-O 121.187 0.411 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.451 ' CG ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.95 14.67 31.31 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-O 123.021 1.391 . . . . 0.0 110.171 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.551 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.258 0.1 OUTLIER -56.35 159.9 3.35 Favored 'General case' 0 C--N 1.267 -2.993 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.66 179.75 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.611 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -163.5 -19.74 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.954 -1.091 . . . . 0.0 113.142 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -103.09 -70.42 0.76 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.43 -1.419 . . . . 0.0 110.024 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.01 -13.77 60.48 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.18 0.99 . . . . 0.0 108.506 178.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.626 ' CD1' ' N ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.9 -20.01 53.67 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.236 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.626 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.54 -55.82 5.81 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.197 -0.939 . . . . 0.0 108.762 178.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.632 ' HA ' ' CG ' ' A' ' 43' ' ' PHE . 2.8 mm? -58.77 -25.89 63.49 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 121.679 0.752 . . . . 0.0 109.489 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.496 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -62.99 -50.57 70.21 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -86.89 -14.53 41.68 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.629 -0.67 . . . . 0.0 110.464 179.688 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.632 ' CG ' ' HA ' ' A' ' 40' ' ' LEU . 0.6 OUTLIER -40.32 -42.36 1.53 Allowed 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 121.38 0.609 . . . . 0.0 110.239 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -75.76 13.63 0.79 Allowed 'General case' 0 C--N 1.307 -1.28 0 O-C-N 121.322 -0.861 . . . . 0.0 112.77 -178.839 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -131.64 -104.99 1.0 Allowed Glycine 0 C--N 1.288 -2.111 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -91.29 33.04 0.99 Allowed 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.67 -0.9 . . . . 0.0 110.991 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -84.4 -48.55 5.0 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 108.398 -1.881 . . . . 0.0 108.398 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.283 -2.325 0 CA-C-N 114.521 -0.84 . . . . 0.0 111.012 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 N--CA 1.483 0.888 0 CA-C-O 121.313 0.464 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -96.28 13.87 26.11 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 123.14 1.447 . . . . 0.0 109.833 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.543 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.255 4.5 mmtp -70.54 157.0 38.67 Favored 'General case' 0 C--N 1.267 -2.978 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.785 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.622 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -167.19 -27.08 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 O-C-N 121.086 -1.009 . . . . 0.0 111.779 179.595 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 26.7 t70 -101.64 -69.96 0.76 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.04 -1.037 . . . . 0.0 109.522 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.531 ' CB ' ' HE2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -61.35 -16.13 43.1 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-O 122.077 0.942 . . . . 0.0 108.568 178.234 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.622 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.47 -18.98 54.08 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.298 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.597 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.39 -57.12 4.29 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.271 -0.893 . . . . 0.0 109.545 179.284 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.605 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.2 mm? -61.53 -32.75 72.82 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.549 -0.719 . . . . 0.0 109.717 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.463 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -44.36 -32.47 1.34 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 120.934 -1.104 . . . . 0.0 108.67 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -91.22 -16.91 26.89 Favored 'General case' 0 C--N 1.309 -1.192 0 O-C-N 121.729 -0.607 . . . . 0.0 111.649 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.605 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.4 m-85 -48.68 -17.61 0.19 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.291 -0.881 . . . . 0.0 111.41 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.8 OUTLIER -68.58 13.45 0.1 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.941 -1.099 . . . . 0.0 113.269 -178.608 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.439 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -89.32 -93.72 1.12 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.432 ' OD1' ' N ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -99.46 60.59 1.15 Allowed 'General case' 0 C--N 1.297 -1.691 0 O-C-N 121.709 -0.877 . . . . 0.0 109.541 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -141.57 -77.48 0.05 OUTLIER Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.136 -1.586 . . . . 0.0 109.136 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.504 HG13 ' HA ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.296 -1.745 0 O-C-N 122.103 -0.645 . . . . 0.0 110.903 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.481 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 41.2 Cg_endo . . . . . 0 N--CA 1.483 0.9 0 CA-C-O 121.343 0.476 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.16 10.69 23.51 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.886 1.326 . . . . 0.0 110.537 -179.271 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 38' ' ' TYR 0.258 0.0 OUTLIER -63.33 114.79 4.04 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.035 179.552 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.597 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -140.44 -13.84 1.0 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 118.931 -1.107 . . . . 0.0 112.418 -179.414 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 63.8 t0 -107.1 -70.32 0.8 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.153 -0.967 . . . . 0.0 109.785 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -63.2 -15.78 58.05 Favored 'General case' 0 C--N 1.283 -2.319 0 CA-C-O 122.207 1.004 . . . . 0.0 108.466 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.608 ' CD1' ' N ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -79.97 -18.61 49.9 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.673 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.23 -56.99 4.96 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.156 -0.965 . . . . 0.0 109.588 179.636 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.604 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.3 mm? -61.16 -35.93 78.46 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.471 -0.768 . . . . 0.0 109.59 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.451 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -46.25 -35.36 5.16 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.952 -1.093 . . . . 0.0 108.5 178.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -90.82 -18.34 25.05 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.804 -0.56 . . . . 0.0 111.44 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.604 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.2 m-85 -45.73 -26.62 0.67 Allowed 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.164 -0.96 . . . . 0.0 110.235 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.628 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.6 mptp? -75.67 13.37 0.82 Allowed 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.351 -0.843 . . . . 0.0 112.559 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.3 -95.09 0.83 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.11 59.62 2.28 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.751 -0.853 . . . . 0.0 109.56 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -139.31 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.485 1.959 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.487 HG11 ' HA ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.801 0 CA-C-O 121.456 0.646 . . . . 0.0 111.328 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo . . . . . 0 N--CA 1.481 0.788 0 CA-C-O 121.313 0.464 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -95.38 17.0 15.36 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 123.198 1.475 . . . . 0.0 109.473 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.549 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.259 0.1 OUTLIER -50.94 151.62 2.48 Favored 'General case' 0 C--N 1.269 -2.902 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.02 179.966 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.606 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -157.45 -27.0 0.09 Allowed 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.207 -0.933 . . . . 0.0 111.975 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -98.58 -69.79 0.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.921 -1.112 . . . . 0.0 109.579 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -61.88 -15.04 39.4 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 121.965 0.888 . . . . 0.0 109.056 178.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.606 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -80.68 -19.28 45.52 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.876 -179.51 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.583 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.9 -56.46 5.41 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 120.99 -1.069 . . . . 0.0 109.343 178.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.61 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.3 mm? -60.33 -34.75 74.27 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.69 0.757 . . . . 0.0 109.734 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.47 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -43.61 -35.64 1.83 Allowed 'General case' 0 C--N 1.3 -1.551 0 O-C-N 120.902 -1.124 . . . . 0.0 108.746 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -90.76 -19.1 23.88 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.712 -0.617 . . . . 0.0 111.417 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.61 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.6 m-85 -46.46 -38.61 9.38 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.206 -0.934 . . . . 0.0 110.32 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.0 OUTLIER -75.19 13.2 0.75 Allowed 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.345 -0.847 . . . . 0.0 112.796 -178.47 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.46 -94.69 0.1 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.21 38.33 0.17 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.628 -0.924 . . . . 0.0 111.419 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -88.46 -50.32 3.42 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 108.142 -1.983 . . . . 0.0 108.142 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.287 -2.138 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.079 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo . . . . . 0 N--CA 1.48 0.735 0 N-CA-C 110.756 -0.517 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.46 2.08 53.52 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 123.145 1.45 . . . . 0.0 110.166 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HD3' ' HB3' ' A' ' 38' ' ' TYR 0.251 1.3 mmtp -67.91 153.77 43.0 Favored 'General case' 0 C--N 1.264 -3.139 0 CA-C-N 113.997 -1.456 . . . . 0.0 110.046 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.599 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.09 -24.67 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.05 -1.031 . . . . 0.0 112.236 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -70.75 0.71 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.916 -1.115 . . . . 0.0 110.014 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.73 -13.35 54.44 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-O 122.002 0.906 . . . . 0.0 108.765 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.599 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.57 -19.58 49.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.428 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -47.47 -56.64 6.61 Favored 'General case' 0 C--N 1.306 -1.283 0 O-C-N 121.065 -1.022 . . . . 0.0 109.152 178.893 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.601 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 1.8 mm? -58.64 -34.15 70.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.856 0.836 . . . . 0.0 109.219 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.471 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -47.22 -35.87 8.13 Favored 'General case' 0 C--N 1.297 -1.716 0 O-C-N 120.928 -1.108 . . . . 0.0 108.049 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HD3' ' OD1' ' A' ' 46' ' ' ASP . 3.4 mtt180 -90.5 -20.61 22.49 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 121.809 -0.557 . . . . 0.0 111.452 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.601 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.1 m-85 -42.66 -34.83 0.96 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.205 -0.934 . . . . 0.0 109.965 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.5 mptt -77.81 13.29 1.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.416 -0.803 . . . . 0.0 112.224 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -151.54 -96.01 0.13 Allowed Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.458 ' OD1' ' HD3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -84.35 55.78 3.5 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.716 -0.873 . . . . 0.0 109.284 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -129.88 -77.82 0.19 Allowed Glycine 0 N--CA 1.487 2.099 0 N-CA-C 108.379 -1.889 . . . . 0.0 108.379 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.294 -1.825 0 O-C-N 122.003 -0.704 . . . . 0.0 110.499 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.513 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.2 Cg_endo . . . . . 0 N--CA 1.483 0.88 0 CA-C-O 121.409 0.504 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.446 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.6 9.34 16.36 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.908 1.337 . . . . 0.0 111.039 -178.827 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.537 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.262 0.0 OUTLIER -60.72 161.22 8.17 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.22 179.352 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.617 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -163.79 -26.66 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.724 -1.235 . . . . 0.0 112.402 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -97.17 -70.55 0.71 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.794 -1.191 . . . . 0.0 110.104 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.1 -13.78 50.13 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.968 0.889 . . . . 0.0 109.022 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.617 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.88 -19.52 48.06 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.186 -179.434 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.598 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -49.31 -55.69 11.98 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 120.804 -1.185 . . . . 0.0 108.793 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.608 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.3 mm? -59.19 -25.76 64.23 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.932 0.872 . . . . 0.0 109.341 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.519 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -54.3 -37.58 64.95 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 120.957 -1.09 . . . . 0.0 108.197 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' LYS . 18.3 mmm180 -90.23 -18.33 25.88 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.412 0.625 . . . . 0.0 111.187 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.585 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.1 m-85 -43.33 -23.12 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.311 -0.868 . . . . 0.0 110.799 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.53 12.81 0.56 Allowed 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.108 -0.995 . . . . 0.0 112.441 -178.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.404 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -74.0 -84.16 0.31 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 110.089 -1.204 . . . . 0.0 110.089 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.25 59.39 2.61 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.617 0.722 . . . . 0.0 109.484 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -139.83 -76.98 0.05 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.768 0 O-C-N 122.094 -0.65 . . . . 0.0 110.702 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo . . . . . 0 N--CA 1.482 0.841 0 N-CA-C 110.734 -0.525 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.517 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -91.18 7.3 41.36 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 123.234 1.492 . . . . 0.0 110.271 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.526 ' NZ ' ' HB2' ' A' ' 37' ' ' GLU 0.259 0.3 OUTLIER -73.44 138.08 44.96 Favored 'General case' 0 C--N 1.263 -3.166 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.446 179.742 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.594 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -170.76 -25.99 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.257 -0.902 . . . . 0.0 111.403 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -102.79 -69.74 0.78 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.139 -0.976 . . . . 0.0 109.059 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.526 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 4.7 mt-10 -63.13 -15.1 55.66 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.594 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.73 -19.52 52.16 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.326 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.585 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -45.64 -56.35 5.3 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.121 -0.987 . . . . 0.0 109.541 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.603 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.2 mm? -62.73 -37.94 88.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' A' ' 38' ' ' TYR . . . -45.81 -39.28 8.18 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.823 -1.173 . . . . 0.0 108.792 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.445 ' HD3' ' HB2' ' A' ' 46' ' ' ASP . 8.0 mtt180 -91.0 -17.21 26.66 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.714 -0.616 . . . . 0.0 111.767 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.582 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.5 m-85 -44.16 -42.28 6.3 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.217 -0.927 . . . . 0.0 110.96 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -73.34 12.93 0.5 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.191 -0.943 . . . . 0.0 112.966 -178.58 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -160.27 -96.66 0.11 Allowed Glycine 0 C--N 1.286 -2.217 0 C-N-CA 120.013 -1.089 . . . . 0.0 110.404 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.445 ' HB2' ' HD3' ' A' ' 42' ' ' ARG . 5.9 m-20 -75.55 36.44 0.13 Allowed 'General case' 0 C--N 1.296 -1.735 0 O-C-N 121.617 -0.931 . . . . 0.0 112.011 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -88.57 -50.12 3.45 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.285 -2.214 0 CA-C-N 114.763 -0.718 . . . . 0.0 110.884 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 N--CA 1.481 0.77 0 N-CA-C 110.848 -0.482 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.97 12.63 33.56 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 123.155 1.455 . . . . 0.0 109.848 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.548 ' CD ' ' HB3' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -61.49 158.39 14.99 Favored 'General case' 0 C--N 1.267 -3.0 0 CA-C-N 113.925 -1.489 . . . . 0.0 110.52 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.621 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.53 -24.92 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 O-C-N 121.028 -1.045 . . . . 0.0 112.395 179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 m-20 -100.2 -70.41 0.74 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.814 -1.179 . . . . 0.0 109.873 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -62.83 -15.1 52.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-O 122.071 0.938 . . . . 0.0 108.663 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.621 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.93 -19.27 52.21 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.348 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.589 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.06 -56.96 4.2 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.211 -0.931 . . . . 0.0 109.48 178.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.598 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.4 mm? -62.51 -37.99 88.19 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.614 0.721 . . . . 0.0 109.869 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.43 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -47.34 -37.12 10.44 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.718 -1.239 . . . . 0.0 108.461 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -19.25 23.94 Favored 'General case' 0 C--N 1.308 -1.196 0 O-C-N 121.739 -0.601 . . . . 0.0 111.5 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.569 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.5 m-30 -43.92 -44.05 6.85 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.253 -0.904 . . . . 0.0 110.436 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.618 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.6 mptm? -74.42 13.32 0.61 Allowed 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.251 -0.906 . . . . 0.0 112.321 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -52.66 -82.03 0.05 OUTLIER Glycine 0 N--CA 1.489 2.218 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.77 65.04 0.99 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-O 121.848 0.832 . . . . 0.0 109.97 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -145.12 -69.35 0.02 OUTLIER Glycine 0 N--CA 1.486 2.031 0 N-CA-C 108.389 -1.885 . . . . 0.0 108.389 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.463 ' CG1' ' HB3' ' A' ' 44' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.291 -1.949 0 O-C-N 122.344 -0.504 . . . . 0.0 111.864 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo . . . . . 0 N--CA 1.482 0.809 0 N-CA-C 110.739 -0.523 . . . . 0.0 110.739 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.448 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.88 13.79 19.41 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 123.141 1.448 . . . . 0.0 109.841 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.553 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -64.12 153.29 38.12 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.702 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.625 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -159.64 -29.18 0.07 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.154 -0.966 . . . . 0.0 111.705 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.449 ' O ' HD22 ' A' ' 39' ' ' LEU . 1.5 t0 -93.43 -69.82 0.73 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.161 -0.962 . . . . 0.0 109.829 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 0.8 OUTLIER -64.19 -13.64 49.98 Favored 'General case' 0 C--N 1.287 -2.144 0 CA-C-O 121.902 0.858 . . . . 0.0 109.152 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -82.84 -17.83 42.54 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 121.308 0.575 . . . . 0.0 110.076 -179.816 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.561 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -47.72 -55.59 9.2 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.212 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.598 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.4 mm? -58.67 -33.55 70.25 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-O 121.963 0.887 . . . . 0.0 109.095 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.493 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -48.67 -43.05 36.5 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.978 -1.076 . . . . 0.0 108.299 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 44' ' ' LYS . 2.1 mmp_? -90.61 -16.58 28.42 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.733 -0.604 . . . . 0.0 111.591 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.578 ' CG ' ' HA ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -42.35 -24.48 0.05 Allowed 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 110.793 -179.051 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -70.93 12.87 0.23 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.092 -1.005 . . . . 0.0 112.897 -178.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.402 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -126.28 -104.09 1.37 Allowed Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 46' ' ' ASP . 1.5 m-20 -82.15 35.63 0.44 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.374 -1.074 . . . . 0.0 110.819 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -89.82 -51.84 2.75 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 108.552 -1.819 . . . . 0.0 108.552 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.288 -2.081 0 CA-C-N 114.948 -0.626 . . . . 0.0 110.536 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.491 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.0 Cg_endo . . . . . 0 N--CA 1.485 0.983 0 CA-C-O 121.514 0.547 . . . . 0.0 111.602 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -79.32 2.38 21.69 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.909 1.338 . . . . 0.0 111.503 -178.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.524 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.251 0.1 OUTLIER -66.15 149.28 50.55 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.762 178.968 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.621 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.25 -24.87 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.993 -1.067 . . . . 0.0 112.226 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -97.2 -70.08 0.73 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.97 -1.081 . . . . 0.0 109.722 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -13.12 57.11 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 121.914 0.864 . . . . 0.0 109.031 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.621 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -81.2 -19.11 43.98 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.113 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -50.31 -56.64 10.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.009 -1.057 . . . . 0.0 109.406 179.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.603 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.3 mm? -63.33 -32.25 73.61 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.461 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -45.42 -37.45 5.11 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.877 -1.139 . . . . 0.0 108.883 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.43 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -90.29 -18.58 25.35 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.645 -0.659 . . . . 0.0 111.5 -179.866 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.594 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.6 m-85 -44.29 -33.79 1.72 Allowed 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.093 -1.004 . . . . 0.0 110.101 -179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.617 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 9.6 mptt -77.51 12.18 1.7 Allowed 'General case' 0 C--N 1.308 -1.201 0 O-C-N 121.163 -0.96 . . . . 0.0 112.079 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -115.05 -100.72 2.32 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.24 33.13 0.39 Allowed 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.509 -0.995 . . . . 0.0 110.473 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.46 -51.89 3.17 Favored Glycine 0 N--CA 1.485 1.933 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.286 -2.193 0 CA-C-N 114.972 -0.614 . . . . 0.0 110.288 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo . . . . . 0 N--CA 1.483 0.865 0 CA-C-O 121.327 0.47 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.9 9.93 28.44 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 123.038 1.399 . . . . 0.0 110.242 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.529 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -60.75 151.51 29.31 Favored 'General case' 0 C--N 1.267 -2.983 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.844 179.298 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.602 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.49 -23.15 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.987 -1.07 . . . . 0.0 112.563 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -99.59 -70.07 0.74 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.76 -1.212 . . . . 0.0 109.868 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.89 -13.95 58.17 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-O 121.992 0.901 . . . . 0.0 108.774 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.609 ' CD1' ' N ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -79.5 -19.45 49.66 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.719 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.609 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -48.92 -56.99 7.18 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.173 -0.954 . . . . 0.0 109.364 179.429 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.592 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.5 mm? -61.8 -32.35 72.64 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.666 0.746 . . . . 0.0 110.001 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.45 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -45.55 -36.92 4.95 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 120.943 -1.098 . . . . 0.0 108.814 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.3 OUTLIER -90.53 -19.83 23.34 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.627 -0.671 . . . . 0.0 111.644 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.583 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.2 m-85 -41.98 -41.8 2.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.214 -0.929 . . . . 0.0 110.45 -179.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.616 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.87 12.98 0.57 Allowed 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.019 -1.051 . . . . 0.0 112.364 -179.32 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -87.42 -99.81 0.87 Allowed Glycine 0 C--N 1.288 -2.096 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -81.14 38.69 0.48 Allowed 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.529 -0.983 . . . . 0.0 110.817 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -100.51 -63.07 0.79 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.287 -2.124 0 CA-C-O 121.561 0.696 . . . . 0.0 110.395 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo . . . . . 0 N--CA 1.484 0.939 0 CA-C-O 121.322 0.467 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.92 7.46 34.37 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 123.01 1.386 . . . . 0.0 110.368 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.517 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.256 0.2 OUTLIER -69.7 159.97 32.52 Favored 'General case' 0 C--N 1.266 -3.062 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.191 179.641 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.625 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -167.88 -28.64 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 O-C-N 120.922 -1.111 . . . . 0.0 111.803 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 8.9 t70 -94.78 -70.25 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.063 -1.023 . . . . 0.0 109.97 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.457 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -63.52 -14.47 51.44 Favored 'General case' 0 C--N 1.283 -2.301 0 CA-C-O 122.041 0.924 . . . . 0.0 109.091 178.719 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -82.04 -18.15 44.24 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.088 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.575 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -46.16 -57.11 4.8 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.353 -0.842 . . . . 0.0 109.46 179.074 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.596 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.3 mm? -61.13 -37.93 84.57 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.565 -0.709 . . . . 0.0 109.876 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -43.72 -35.48 1.85 Allowed 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.053 -1.029 . . . . 0.0 108.746 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 43' ' ' PHE . 24.7 mtp180 -91.71 -17.62 25.18 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 121.822 -0.549 . . . . 0.0 112.079 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.59 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -40.12 -61.67 0.85 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.156 -0.965 . . . . 0.0 111.027 -178.465 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.1 mptm? -77.48 13.77 1.15 Allowed 'General case' 0 C--N 1.309 -1.168 0 O-C-N 121.143 -0.973 . . . . 0.0 112.498 -179.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.94 -100.54 1.34 Allowed Glycine 0 C--N 1.287 -2.167 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.434 ' OD1' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -106.9 62.71 0.63 Allowed 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.794 -0.827 . . . . 0.0 109.733 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -145.58 -83.02 0.05 OUTLIER Glycine 0 N--CA 1.485 1.937 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 43' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.298 -1.659 0 O-C-N 121.985 -0.714 . . . . 0.0 110.848 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo . . . . . 0 N--CA 1.483 0.893 0 N-CA-C 110.859 -0.477 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.441 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -94.03 6.88 47.11 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 122.918 1.342 . . . . 0.0 110.532 -179.562 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.534 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.252 0.0 OUTLIER -75.96 142.89 41.86 Favored 'General case' 0 C--N 1.264 -3.149 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.588 179.918 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.591 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -169.05 -25.32 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.267 -0.896 . . . . 0.0 111.618 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.05 -70.38 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.98 -1.075 . . . . 0.0 109.419 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.404 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -65.47 -13.56 59.06 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.038 0.923 . . . . 0.0 108.545 178.118 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.599 ' CD1' ' N ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.12 -19.9 56.36 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.131 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -50.87 -56.53 11.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.28 -0.887 . . . . 0.0 109.357 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.603 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.2 mm? -61.73 -35.17 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.116 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.469 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -43.14 -36.9 1.84 Allowed 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.054 -1.029 . . . . 0.0 109.009 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.4 mtp180 -90.69 -19.57 23.45 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.627 -0.67 . . . . 0.0 111.806 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.603 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.6 m-85 -42.24 -48.88 5.0 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.142 -0.974 . . . . 0.0 110.627 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.2 mptp? -73.62 13.42 0.48 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.17 -0.957 . . . . 0.0 112.822 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.89 -12.77 48.87 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.462 ' OD2' ' O ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -86.4 49.15 1.74 Allowed 'General case' 0 C--N 1.287 -2.122 0 O-C-N 121.766 -0.844 . . . . 0.0 110.116 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -112.8 -73.8 0.65 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.938 0 CA-C-O 121.628 0.727 . . . . 0.0 110.625 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo . . . . . 0 N--CA 1.483 0.891 0 N-CA-C 110.927 -0.451 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.527 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -98.81 7.52 45.97 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 123.166 1.46 . . . . 0.0 110.201 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.543 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 1.7 mmtp -69.37 153.6 43.33 Favored 'General case' 0 C--N 1.265 -3.086 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.596 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.605 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -165.66 -24.65 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.139 -0.976 . . . . 0.0 112.113 179.719 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 23.3 t0 -101.37 -69.76 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.717 -1.239 . . . . 0.0 109.276 179.161 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.2 -14.88 54.13 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 178.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.605 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.17 -19.54 50.68 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.69 -56.41 4.45 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.158 -0.964 . . . . 0.0 109.424 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.597 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.6 mm? -59.33 -32.39 70.05 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.848 0.832 . . . . 0.0 109.456 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.446 ' HB2' ' O ' ' A' ' 38' ' ' TYR . . . -57.61 -41.48 81.37 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.497 ' O ' ' N ' ' A' ' 44' ' ' LYS . 16.3 mmt180 -90.18 -16.7 28.96 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.435 0.636 . . . . 0.0 111.205 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.573 ' CG ' ' HA ' ' A' ' 40' ' ' LEU . 0.7 OUTLIER -39.77 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.474 -0.766 . . . . 0.0 111.318 -179.033 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.597 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.7 OUTLIER -74.1 12.83 0.64 Allowed 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.85 -1.156 . . . . 0.0 112.378 -179.198 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.443 ' O ' ' N ' ' A' ' 47' ' ' GLY . . . -42.65 -69.87 0.56 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.5 59.87 0.06 Allowed 'General case' 0 C--N 1.288 -2.085 0 CA-C-O 121.86 0.838 . . . . 0.0 109.422 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 45' ' ' GLY . . . -140.23 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.316 -1.514 . . . . 0.0 109.316 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.771 0 O-C-N 121.943 -0.74 . . . . 0.0 111.592 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo . . . . . 0 N--CA 1.484 0.918 0 CA-C-O 121.264 0.443 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -87.24 4.53 42.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-O 123.161 1.457 . . . . 0.0 110.526 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.531 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.264 0.1 OUTLIER -70.13 160.7 31.57 Favored 'General case' 0 C--N 1.264 -3.142 0 CA-C-N 113.975 -1.466 . . . . 0.0 110.424 179.53 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.625 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.28 -22.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.645 -1.284 . . . . 0.0 112.63 179.725 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.0 -70.3 0.77 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.685 -1.26 . . . . 0.0 109.606 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -14.54 49.79 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.076 0.941 . . . . 0.0 108.647 178.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.18 -19.0 52.0 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.677 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.615 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.83 -56.44 6.28 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.112 -0.992 . . . . 0.0 109.704 179.675 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.612 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.2 mm? -63.41 -23.64 67.49 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.824 0.821 . . . . 0.0 109.885 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -56.78 -40.84 76.61 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.041 -1.037 . . . . 0.0 108.844 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.7 mmt-85 -89.84 -17.41 28.16 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.687 -0.633 . . . . 0.0 111.505 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.559 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 0.9 OUTLIER -39.47 -36.93 0.42 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.399 -0.813 . . . . 0.0 110.735 -179.297 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 2.7 mptt -76.09 13.8 0.82 Allowed 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.171 -0.956 . . . . 0.0 112.638 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -127.85 -72.86 0.17 Allowed Glycine 0 N--CA 1.49 2.268 0 C-N-CA 120.115 -1.041 . . . . 0.0 110.526 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -75.71 39.56 0.17 Allowed 'General case' 0 C--N 1.289 -2.045 0 O-C-N 121.879 -0.777 . . . . 0.0 111.342 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -98.68 -62.03 0.86 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.29 -1.988 0 CA-C-O 121.613 0.721 . . . . 0.0 110.51 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.507 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.5 Cg_endo . . . . . 0 N--CA 1.486 1.048 0 CA-C-O 121.593 0.58 . . . . 0.0 111.688 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.443 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.74 5.39 32.5 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 123.027 1.394 . . . . 0.0 110.879 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.587 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.261 0.0 OUTLIER -66.43 164.52 16.13 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 114.055 -1.43 . . . . 0.0 110.655 179.912 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.62 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 1.3 m -166.16 -22.12 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.938 -1.102 . . . . 0.0 112.733 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -103.22 -70.65 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.552 -1.343 . . . . 0.0 109.81 179.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.47 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 19.7 mt-10 -63.5 -15.11 56.92 Favored 'General case' 0 C--N 1.284 -2.276 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.62 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -77.73 -19.11 55.75 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.306 -179.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -44.33 -55.67 4.77 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.779 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.603 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.6 mm? -60.53 -26.67 67.05 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.85 0.833 . . . . 0.0 109.384 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.518 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -58.7 -41.03 85.35 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.05 -1.031 . . . . 0.0 108.224 178.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 44' ' ' LYS . 7.2 mmm-85 -89.73 -16.22 30.81 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.393 0.616 . . . . 0.0 110.82 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.572 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -42.04 -25.08 0.06 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.382 -0.824 . . . . 0.0 110.337 -179.644 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.611 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.6 mptp? -72.45 12.97 0.39 Allowed 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.217 -0.927 . . . . 0.0 112.871 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -89.65 -101.63 1.09 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 108.663 -1.775 . . . . 0.0 108.663 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 46' ' ' ASP . 0.4 OUTLIER -85.91 33.77 0.6 Allowed 'General case' 0 C--N 1.296 -1.721 0 O-C-N 121.554 -0.968 . . . . 0.0 109.938 179.394 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -97.72 -64.93 0.89 Allowed Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.289 -2.036 0 CA-C-O 121.429 0.633 . . . . 0.0 110.477 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo . . . . . 0 N--CA 1.483 0.881 0 N-CA-C 110.939 -0.447 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.83 8.84 37.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 123.16 1.457 . . . . 0.0 110.235 -179.548 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.457 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.257 0.0 OUTLIER -62.01 157.64 18.27 Favored 'General case' 0 C--N 1.268 -2.958 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.26 179.532 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.613 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.1 -23.73 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.748 -1.22 . . . . 0.0 112.716 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t0 -101.5 -70.33 0.75 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.717 -1.239 . . . . 0.0 109.881 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.13 -14.74 52.17 Favored 'General case' 0 C--N 1.282 -2.348 0 CA-C-O 122.031 0.92 . . . . 0.0 108.572 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.613 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.85 -19.16 49.0 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.482 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -44.09 -56.2 4.2 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.616 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.5 mm? -64.91 -32.02 73.53 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.651 -0.656 . . . . 0.0 110.076 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.47 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -42.98 -33.1 0.74 Allowed 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.045 -1.034 . . . . 0.0 109.085 178.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -90.71 -17.35 26.91 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.346 0.594 . . . . 0.0 111.427 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.592 ' CD1' ' HA ' ' A' ' 40' ' ' LEU . 2.8 m-85 -55.49 -11.98 1.01 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.312 -0.868 . . . . 0.0 111.241 -179.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.596 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.8 mptt -70.53 13.54 0.17 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.049 -1.032 . . . . 0.0 113.207 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.41 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -59.84 -90.21 0.02 OUTLIER Glycine 0 N--CA 1.488 2.119 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -85.67 30.02 0.67 Allowed 'General case' 0 C--N 1.293 -1.883 0 O-C-N 121.874 -0.78 . . . . 0.0 110.521 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -88.28 -54.53 2.4 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.284 -2.245 0 CA-C-O 121.373 0.606 . . . . 0.0 110.381 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo . . . . . 0 N--CA 1.482 0.808 0 N-CA-C 110.928 -0.451 . . . . 0.0 110.928 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.45 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.6 8.91 31.83 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.214 1.483 . . . . 0.0 110.047 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.599 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.268 0.4 OUTLIER -70.66 -178.81 1.93 Allowed 'General case' 0 C--N 1.266 -3.022 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.772 179.784 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.625 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.63 -18.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.774 -1.204 . . . . 0.0 113.574 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.431 ' HA ' HD21 ' A' ' 39' ' ' LEU . 32.5 t70 -106.67 -70.97 0.77 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.384 -1.447 . . . . 0.0 110.506 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.471 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 6.4 mt-10 -63.25 -14.25 47.33 Favored 'General case' 0 C--N 1.283 -2.299 0 CA-C-O 122.25 1.024 . . . . 0.0 108.388 178.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.37 -18.51 52.24 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.405 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.35 -57.0 3.77 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.169 179.725 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.604 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.1 mm? -61.46 -37.49 83.77 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.554 -0.716 . . . . 0.0 109.508 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.448 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -47.41 -33.05 5.56 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.677 -1.265 . . . . 0.0 108.006 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.485 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -90.79 -20.19 22.63 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.916 -0.49 . . . . 0.0 111.347 179.79 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.604 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -43.18 -45.86 5.75 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.22 -0.925 . . . . 0.0 109.728 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.646 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 8.4 mptt -78.53 13.13 1.7 Allowed 'General case' 0 C--N 1.308 -1.237 0 O-C-N 121.333 -0.854 . . . . 0.0 111.83 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.485 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -74.2 -91.35 0.15 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -99.42 61.94 1.21 Allowed 'General case' 0 C--N 1.295 -1.767 0 O-C-N 121.695 -0.885 . . . . 0.0 109.705 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -139.8 -72.31 0.04 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.669 -1.773 . . . . 0.0 108.669 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.422 HG12 ' HA ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.896 0 CA-C-O 121.386 0.612 . . . . 0.0 111.982 -179.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo . . . . . 0 N--CA 1.482 0.827 0 CA-C-O 121.246 0.436 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -99.36 10.29 41.68 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 123.271 1.51 . . . . 0.0 109.843 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.574 ' CD ' ' HB2' ' A' ' 38' ' ' TYR 0.266 0.1 OUTLIER -81.64 91.25 6.39 Favored 'General case' 0 C--N 1.267 -3.017 0 CA-C-N 113.798 -1.546 . . . . 0.0 110.177 179.824 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.641 ' CA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -154.5 -30.72 0.11 Allowed 'General case' 0 C--N 1.291 -1.96 0 O-C-N 121.642 -0.661 . . . . 0.0 110.569 -179.792 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 2.9 t0 -107.19 -68.72 0.88 Allowed 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -13.39 59.91 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.641 ' CD1' ' CA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -80.33 -19.89 45.49 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.202 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.58 -56.53 5.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.166 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.597 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.1 mm? -60.78 -35.58 76.8 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.739 0.78 . . . . 0.0 109.839 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.422 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -46.85 -38.97 11.14 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 120.847 -1.158 . . . . 0.0 108.555 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -90.82 -17.46 26.55 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.715 -0.616 . . . . 0.0 111.722 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.597 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.3 m-85 -44.66 -40.01 5.53 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 110.977 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.6 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -68.76 14.55 0.07 Allowed 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.404 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -108.47 -103.35 2.84 Favored Glycine 0 C--N 1.288 -2.137 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.024 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.91 65.73 0.64 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.904 0.859 . . . . 0.0 109.956 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -142.68 -75.84 0.04 OUTLIER Glycine 0 N--CA 1.485 1.905 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.519 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.3 OUTLIER . . . . . 0 C--N 1.293 -1.85 0 CA-C-O 121.398 0.618 . . . . 0.0 111.283 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.471 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.3 Cg_endo . . . . . 0 N--CA 1.483 0.89 0 CA-C-O 121.348 0.478 . . . . 0.0 111.28 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -93.88 12.87 24.44 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 123.279 1.514 . . . . 0.0 110.088 -179.557 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.538 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.26 0.1 OUTLIER -60.67 157.19 15.1 Favored 'General case' 0 C--N 1.265 -3.07 0 CA-C-N 113.957 -1.474 . . . . 0.0 110.641 179.473 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.604 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -165.5 -27.04 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.928 -1.108 . . . . 0.0 111.797 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.4 OUTLIER -97.33 -70.85 0.7 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.915 -1.115 . . . . 0.0 109.774 179.488 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -63.55 -14.65 53.32 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 122.005 0.907 . . . . 0.0 108.667 178.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.604 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.58 -19.79 51.99 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.266 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -45.62 -56.04 5.65 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.214 -0.929 . . . . 0.0 108.994 178.619 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.617 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.4 mm? -62.37 -24.83 67.58 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 121.844 0.831 . . . . 0.0 109.758 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.51 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -55.22 -44.76 75.73 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.085 -1.009 . . . . 0.0 108.567 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.433 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.1 OUTLIER -89.49 -17.78 27.99 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.382 0.61 . . . . 0.0 110.998 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.597 ' CG ' ' HA ' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -41.05 -44.31 2.39 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.419 -0.8 . . . . 0.0 110.335 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.619 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 12.0 mptt -73.0 14.37 0.29 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.043 -1.036 . . . . 0.0 113.151 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -156.46 -99.24 0.16 Allowed Glycine 0 N--CA 1.489 2.225 0 C-N-CA 119.491 -1.337 . . . . 0.0 111.702 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.45 58.85 3.27 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.677 -0.896 . . . . 0.0 110.252 -178.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.73 -67.35 0.1 OUTLIER Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.202 -1.959 . . . . 0.0 108.202 179.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.524 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.901 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.424 ' O ' ' N ' ' A' ' 26' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.21 0.528 . . . . 0.0 110.127 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -42.78 99.26 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.281 -0.887 . . . . 0.0 110.341 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -178.68 101.19 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.276 -0.89 . . . . 0.0 110.466 179.661 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.467 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 41.92 87.32 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.353 -0.842 . . . . 0.0 110.66 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.467 ' O ' ' O ' ' A' ' 27' ' ' GLU . 1.7 mttt -55.11 -164.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.3 -0.875 . . . . 0.0 110.222 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -45.75 148.59 0.73 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.215 -0.928 . . . . 0.0 110.444 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 31' ' ' GLY . 0.2 OUTLIER -48.87 137.17 12.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 110.712 -179.699 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.465 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 41.26 -165.34 0.01 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 110.326 -1.109 . . . . 0.0 110.326 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.64 160.31 48.67 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 124.219 1.642 . . . . 0.0 111.217 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.451 ' CG ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.95 14.67 31.31 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-O 123.021 1.391 . . . . 0.0 110.171 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.551 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.258 0.1 OUTLIER -56.35 159.9 3.35 Favored 'General case' 0 C--N 1.267 -2.993 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.66 179.75 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.611 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -163.5 -19.74 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.954 -1.091 . . . . 0.0 113.142 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -103.09 -70.42 0.76 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.43 -1.419 . . . . 0.0 110.024 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.01 -13.77 60.48 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.18 0.99 . . . . 0.0 108.506 178.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.626 ' CD1' ' N ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.9 -20.01 53.67 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.236 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.626 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.54 -55.82 5.81 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.197 -0.939 . . . . 0.0 108.762 178.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.632 ' HA ' ' CG ' ' A' ' 43' ' ' PHE . 2.8 mm? -58.77 -25.89 63.49 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 121.679 0.752 . . . . 0.0 109.489 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.496 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -62.99 -50.57 70.21 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -86.89 -14.53 41.68 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.629 -0.67 . . . . 0.0 110.464 179.688 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.632 ' CG ' ' HA ' ' A' ' 40' ' ' LEU . 0.6 OUTLIER -40.32 -42.36 1.53 Allowed 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 121.38 0.609 . . . . 0.0 110.239 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -75.76 13.63 0.79 Allowed 'General case' 0 C--N 1.307 -1.28 0 O-C-N 121.322 -0.861 . . . . 0.0 112.77 -178.839 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -131.64 -104.99 1.0 Allowed Glycine 0 C--N 1.288 -2.111 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.603 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 1.9 m-20 -91.29 33.04 0.99 Allowed 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.67 -0.9 . . . . 0.0 110.991 -178.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.612 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -84.4 -48.55 5.0 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 108.398 -1.881 . . . . 0.0 108.398 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.426 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -57.87 -46.79 87.33 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.325 0 CA-C-N 114.521 -0.84 . . . . 0.0 111.012 179.935 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.527 ' CG ' ' O ' ' A' ' 46' ' ' ASP . 1.1 ptpt -42.93 -59.37 2.02 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.136 -0.977 . . . . 0.0 111.795 -178.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.662 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.5 p90 -86.26 -28.19 23.95 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 120.579 -1.325 . . . . 0.0 110.6 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.662 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -48.71 -54.31 15.36 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.645 -1.284 . . . . 0.0 109.029 179.203 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.494 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -53.34 -53.85 45.0 Favored 'General case' 0 C--N 1.285 -2.198 0 CA-C-O 122.522 1.153 . . . . 0.0 110.486 179.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.488 ' HA ' HG12 ' A' ' 57' ' ' ILE . 23.7 mtmt -67.39 -53.32 30.27 Favored 'General case' 0 C--N 1.284 -2.251 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.792 -178.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 33.4 mt -51.21 -21.63 2.17 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 120.817 -1.177 . . . . 0.0 110.756 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.494 ' HB ' ' O ' ' A' ' 52' ' ' ALA 0.329 0.3 OUTLIER -75.52 -57.97 5.39 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 CA-C-O 121.508 0.67 . . . . 0.0 109.751 179.721 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.47 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 133.8 50.97 0.08 OUTLIER Glycine 0 C--N 1.303 -1.267 0 N-CA-C 110.402 -1.079 . . . . 0.0 110.402 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.488 HG12 ' HA ' ' A' ' 53' ' ' LYS 0.264 4.4 pt -78.16 -122.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.167 0 CA-C-O 122.68 1.228 . . . . 0.0 110.075 179.752 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.425 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 16.6 t70 . . . . . 0 C--N 1.259 -3.334 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.275 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.257 0.551 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.69 157.51 0.76 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.253 -0.904 . . . . 0.0 110.53 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.486 ' O ' ' O ' ' A' ' 27' ' ' GLU . 6.9 mmtm -63.5 -11.35 23.28 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.293 -0.879 . . . . 0.0 110.644 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.536 ' O ' ' N ' ' A' ' 29' ' ' LYS . 27.3 tp10 57.89 125.77 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.444 -0.785 . . . . 0.0 110.443 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -40.89 90.45 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.314 -0.866 . . . . 0.0 111.323 -179.738 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' A' ' 27' ' ' GLU . 0.6 OUTLIER -57.19 170.65 0.46 Allowed 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.193 -0.942 . . . . 0.0 110.308 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.524 ' CG ' ' O ' ' A' ' 30' ' ' LYS . 11.7 pttt -50.85 91.22 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.28 -0.888 . . . . 0.0 110.96 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.473 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 51.17 172.42 0.01 OUTLIER Glycine 0 N--CA 1.487 2.085 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 179.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -70.13 156.41 62.44 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 124.005 1.529 . . . . 0.0 111.026 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -96.28 13.87 26.11 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 123.14 1.447 . . . . 0.0 109.833 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.543 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.255 4.5 mmtp -70.54 157.0 38.67 Favored 'General case' 0 C--N 1.267 -2.978 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.785 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.622 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -167.19 -27.08 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 O-C-N 121.086 -1.009 . . . . 0.0 111.779 179.595 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 26.7 t70 -101.64 -69.96 0.76 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.04 -1.037 . . . . 0.0 109.522 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.531 ' CB ' ' HE2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -61.35 -16.13 43.1 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-O 122.077 0.942 . . . . 0.0 108.568 178.234 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.622 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.47 -18.98 54.08 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.298 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.597 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.39 -57.12 4.29 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.271 -0.893 . . . . 0.0 109.545 179.284 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.605 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.2 mm? -61.53 -32.75 72.82 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.549 -0.719 . . . . 0.0 109.717 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.463 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -44.36 -32.47 1.34 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 120.934 -1.104 . . . . 0.0 108.67 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -91.22 -16.91 26.89 Favored 'General case' 0 C--N 1.309 -1.192 0 O-C-N 121.729 -0.607 . . . . 0.0 111.649 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.605 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.4 m-85 -48.68 -17.61 0.19 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.291 -0.881 . . . . 0.0 111.41 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.8 OUTLIER -68.58 13.45 0.1 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.941 -1.099 . . . . 0.0 113.269 -178.608 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.503 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -89.32 -93.72 1.12 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.467 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -99.46 60.59 1.15 Allowed 'General case' 0 C--N 1.297 -1.691 0 O-C-N 121.709 -0.877 . . . . 0.0 109.541 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.572 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -141.57 -77.48 0.05 OUTLIER Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.136 -1.586 . . . . 0.0 109.136 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.504 HG13 ' HA ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -55.06 -44.42 74.2 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.745 0 O-C-N 122.103 -0.645 . . . . 0.0 110.903 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 1.9 ptpt -41.56 -59.3 1.65 Allowed 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.369 -0.832 . . . . 0.0 111.657 -178.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.684 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.5 p90 -92.17 -27.85 17.43 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.402 -1.436 . . . . 0.0 110.967 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.684 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -45.27 -56.19 5.13 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 120.885 -1.134 . . . . 0.0 109.601 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.517 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -61.02 -53.35 58.24 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-O 122.576 1.179 . . . . 0.0 110.758 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -58.17 -51.51 69.42 Favored 'General case' 0 C--N 1.283 -2.325 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.96 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 40.3 mt -51.13 -27.84 9.46 Favored 'General case' 0 C--N 1.309 -1.183 0 O-C-N 120.689 -1.257 . . . . 0.0 110.883 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.517 ' HB ' ' O ' ' A' ' 52' ' ' ALA 0.329 0.3 OUTLIER -75.58 -56.44 8.61 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.993 0 CA-C-O 121.683 0.754 . . . . 0.0 109.887 179.564 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.472 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 121.99 48.33 0.27 Allowed Glycine 0 C--N 1.302 -1.352 0 N-CA-C 109.886 -1.285 . . . . 0.0 109.886 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.451 HG23 HG21 ' A' ' 55' ' ' ILE 0.263 1.9 pt -74.77 -120.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 CA-C-O 122.641 1.21 . . . . 0.0 110.177 179.939 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.427 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 16.9 t70 . . . . . 0 C--N 1.259 -3.329 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.281 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.332 0.587 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.41 ' O ' ' C ' ' A' ' 26' ' ' LYS . 9.8 mmtt -49.75 145.12 5.52 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.223 -0.923 . . . . 0.0 110.785 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' A' ' 27' ' ' GLU . 1.8 tptt -42.28 -65.35 0.47 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.395 -0.816 . . . . 0.0 110.287 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.466 ' O ' ' O ' ' A' ' 26' ' ' LYS . 13.6 tp10 54.37 164.89 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.342 -0.849 . . . . 0.0 110.218 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.459 ' N ' ' HG3' ' A' ' 27' ' ' GLU . 0.3 OUTLIER -50.35 -178.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.281 -0.887 . . . . 0.0 111.036 -179.446 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -54.12 -161.16 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 121.696 0.76 . . . . 0.0 111.154 -179.85 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' GLY . 0.0 OUTLIER -51.84 -166.82 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 121.588 0.709 . . . . 0.0 111.15 -179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -53.54 -163.2 0.01 OUTLIER Glycine 0 N--CA 1.486 1.997 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.481 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 41.2 Cg_endo -66.28 -167.22 0.12 Allowed 'Trans proline' 0 C--N 1.303 -1.837 0 O-C-N 124.166 1.614 . . . . 0.0 111.367 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.16 10.69 23.51 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.886 1.326 . . . . 0.0 110.537 -179.271 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 38' ' ' TYR 0.258 0.0 OUTLIER -63.33 114.79 4.04 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.035 179.552 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.597 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -140.44 -13.84 1.0 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 118.931 -1.107 . . . . 0.0 112.418 -179.414 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 63.8 t0 -107.1 -70.32 0.8 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.153 -0.967 . . . . 0.0 109.785 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -63.2 -15.78 58.05 Favored 'General case' 0 C--N 1.283 -2.319 0 CA-C-O 122.207 1.004 . . . . 0.0 108.466 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.608 ' CD1' ' N ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -79.97 -18.61 49.9 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.673 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.23 -56.99 4.96 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.156 -0.965 . . . . 0.0 109.588 179.636 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.604 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.3 mm? -61.16 -35.93 78.46 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.471 -0.768 . . . . 0.0 109.59 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.451 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -46.25 -35.36 5.16 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.952 -1.093 . . . . 0.0 108.5 178.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -90.82 -18.34 25.05 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.804 -0.56 . . . . 0.0 111.44 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.604 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.2 m-85 -45.73 -26.62 0.67 Allowed 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.164 -0.96 . . . . 0.0 110.235 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.628 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.6 mptp? -75.67 13.37 0.82 Allowed 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.351 -0.843 . . . . 0.0 112.559 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.491 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -86.3 -95.09 0.83 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.444 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -95.11 59.62 2.28 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.751 -0.853 . . . . 0.0 109.56 -179.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.523 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -139.31 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.485 1.959 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.487 HG11 ' HA ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -53.45 -45.39 57.77 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.801 0 CA-C-O 121.456 0.646 . . . . 0.0 111.328 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -41.36 -58.79 1.75 Allowed 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.504 -0.747 . . . . 0.0 111.981 -177.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.66 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.1 p90 -91.95 -27.14 18.07 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.341 -1.474 . . . . 0.0 111.39 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.66 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -54.46 -44.47 72.59 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 120.662 -1.273 . . . . 0.0 109.576 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.498 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -58.45 -54.1 50.81 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-O 122.474 1.131 . . . . 0.0 110.19 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.4 mtpp -69.11 -54.09 16.83 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.933 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 29.9 mt -51.59 -21.73 2.78 Favored 'General case' 0 C--N 1.308 -1.197 0 O-C-N 120.84 -1.162 . . . . 0.0 110.34 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.615 ' CG2' ' CG2' ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -76.12 -59.19 3.42 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 CA-C-O 121.585 0.707 . . . . 0.0 109.849 179.809 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.487 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 84.54 52.96 3.37 Favored Glycine 0 N--CA 1.479 1.5 0 C-N-CA 120.266 -0.969 . . . . 0.0 111.496 178.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.615 ' CG2' ' CG2' ' A' ' 55' ' ' ILE 0.255 1.5 pt -71.88 -119.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 CA-C-O 122.595 1.188 . . . . 0.0 110.058 179.266 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.415 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 31.7 t70 . . . . . 0 C--N 1.26 -3.311 0 CA-C-N 114.673 -1.148 . . . . 0.0 110.528 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.415 ' O ' ' C ' ' A' ' 25' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 121.262 0.554 . . . . 0.0 110.258 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.53 ' O ' ' N ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER 43.43 -159.76 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 110.325 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.5 tptt -42.9 90.49 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.465 -0.772 . . . . 0.0 110.766 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 25' ' ' LYS . 3.5 pt-20 -60.58 158.62 12.04 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 121.231 -0.918 . . . . 0.0 110.781 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 14.7 tttp -50.56 131.47 25.17 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.345 -0.847 . . . . 0.0 110.558 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 31' ' ' GLY . 10.6 ttpp -44.5 108.45 0.12 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.249 -0.907 . . . . 0.0 110.469 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.472 ' O ' ' O ' ' A' ' 31' ' ' GLY . 0.0 OUTLIER -62.16 73.21 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.282 -0.886 . . . . 0.0 110.522 -179.81 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 29' ' ' LYS . . . 43.73 -168.56 0.02 OUTLIER Glycine 0 N--CA 1.485 1.962 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.37 167.99 22.33 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.035 1.545 . . . . 0.0 111.161 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -95.38 17.0 15.36 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 123.198 1.475 . . . . 0.0 109.473 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.549 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.259 0.1 OUTLIER -50.94 151.62 2.48 Favored 'General case' 0 C--N 1.269 -2.902 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.02 179.966 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.606 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -157.45 -27.0 0.09 Allowed 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.207 -0.933 . . . . 0.0 111.975 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -98.58 -69.79 0.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.921 -1.112 . . . . 0.0 109.579 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -61.88 -15.04 39.4 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 121.965 0.888 . . . . 0.0 109.056 178.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.606 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -80.68 -19.28 45.52 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.876 -179.51 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.583 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.9 -56.46 5.41 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 120.99 -1.069 . . . . 0.0 109.343 178.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.61 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.3 mm? -60.33 -34.75 74.27 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.69 0.757 . . . . 0.0 109.734 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.47 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -43.61 -35.64 1.83 Allowed 'General case' 0 C--N 1.3 -1.551 0 O-C-N 120.902 -1.124 . . . . 0.0 108.746 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -90.76 -19.1 23.88 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.712 -0.617 . . . . 0.0 111.417 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.61 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.6 m-85 -46.46 -38.61 9.38 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.206 -0.934 . . . . 0.0 110.32 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.0 OUTLIER -75.19 13.2 0.75 Allowed 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.345 -0.847 . . . . 0.0 112.796 -178.47 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.46 -94.69 0.1 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.609 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 2.5 m-20 -76.21 38.33 0.17 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.628 -0.924 . . . . 0.0 111.419 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.595 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -88.46 -50.32 3.42 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 108.142 -1.983 . . . . 0.0 108.142 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.405 ' O ' ' C ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -56.25 -45.38 81.12 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.138 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.079 179.616 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HE3' ' N ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -42.28 -59.94 1.65 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.301 -0.874 . . . . 0.0 111.73 -177.94 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.685 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.4 p90 -87.25 -27.55 22.87 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 120.272 -1.518 . . . . 0.0 110.684 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.685 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 9.5 mmtt -47.29 -56.52 6.64 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 120.883 -1.136 . . . . 0.0 109.394 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.507 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -49.87 -53.72 23.99 Favored 'General case' 0 C--N 1.283 -2.288 0 CA-C-O 122.427 1.108 . . . . 0.0 110.639 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.6 mttm -67.77 -52.84 32.54 Favored 'General case' 0 C--N 1.284 -2.276 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.033 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.56 HD13 ' CD1' ' A' ' 50' ' ' TYR . 27.3 mt -50.98 -20.79 1.47 Allowed 'General case' 0 C--N 1.308 -1.21 0 O-C-N 120.731 -1.23 . . . . 0.0 110.908 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.509 HG22 ' N ' ' A' ' 56' ' ' GLY 0.329 0.3 OUTLIER -75.13 -57.42 6.44 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 CA-C-O 121.478 0.656 . . . . 0.0 109.897 179.666 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.509 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 129.72 51.06 0.11 Allowed Glycine 0 N--CA 1.475 1.273 0 C-N-CA 120.098 -1.049 . . . . 0.0 110.772 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.456 HG22 HG22 ' A' ' 55' ' ' ILE 0.263 2.4 pt -75.97 -120.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.138 0 CA-C-O 122.617 1.199 . . . . 0.0 110.018 179.504 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.445 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 5.1 t0 . . . . . 0 C--N 1.259 -3.359 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.146 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.409 0.623 . . . . 0.0 110.0 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.404 ' O ' ' CG ' ' A' ' 25' ' ' LYS . 11.9 ptmt -45.57 112.01 0.41 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.257 -0.902 . . . . 0.0 110.581 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.451 ' O ' ' C ' ' A' ' 27' ' ' GLU . 1.4 ttmt -51.27 104.34 0.08 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.193 -0.942 . . . . 0.0 110.178 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.527 ' N ' ' OE2' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -36.68 102.94 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.619 -0.676 . . . . 0.0 111.042 -179.699 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 29' ' ' LYS . 0.6 OUTLIER -41.14 -34.21 0.43 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.261 -0.899 . . . . 0.0 110.252 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -50.73 -174.26 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.376 -0.827 . . . . 0.0 110.362 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' A' ' 31' ' ' GLY . 3.9 mttt -43.64 123.19 3.01 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.148 -0.97 . . . . 0.0 110.075 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.463 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -44.31 169.99 0.01 OUTLIER Glycine 0 N--CA 1.486 2.019 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -67.98 -173.46 0.51 Allowed 'Trans proline' 0 C--N 1.303 -1.829 0 O-C-N 124.082 1.57 . . . . 0.0 110.756 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.46 2.08 53.52 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 123.145 1.45 . . . . 0.0 110.166 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HD3' ' HB3' ' A' ' 38' ' ' TYR 0.251 1.3 mmtp -67.91 153.77 43.0 Favored 'General case' 0 C--N 1.264 -3.139 0 CA-C-N 113.997 -1.456 . . . . 0.0 110.046 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.599 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.09 -24.67 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.05 -1.031 . . . . 0.0 112.236 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -70.75 0.71 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.916 -1.115 . . . . 0.0 110.014 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.73 -13.35 54.44 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-O 122.002 0.906 . . . . 0.0 108.765 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.599 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.57 -19.58 49.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.428 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -47.47 -56.64 6.61 Favored 'General case' 0 C--N 1.306 -1.283 0 O-C-N 121.065 -1.022 . . . . 0.0 109.152 178.893 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.601 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 1.8 mm? -58.64 -34.15 70.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.856 0.836 . . . . 0.0 109.219 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.471 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -47.22 -35.87 8.13 Favored 'General case' 0 C--N 1.297 -1.716 0 O-C-N 120.928 -1.108 . . . . 0.0 108.049 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HD3' ' OD1' ' A' ' 46' ' ' ASP . 3.4 mtt180 -90.5 -20.61 22.49 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 121.809 -0.557 . . . . 0.0 111.452 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.601 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.1 m-85 -42.66 -34.83 0.96 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.205 -0.934 . . . . 0.0 109.965 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.5 mptt -77.81 13.29 1.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.416 -0.803 . . . . 0.0 112.224 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.464 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -151.54 -96.01 0.13 Allowed Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.486 ' HA ' ' CD ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -84.35 55.78 3.5 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.716 -0.873 . . . . 0.0 109.284 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.473 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -129.88 -77.82 0.19 Allowed Glycine 0 N--CA 1.487 2.099 0 N-CA-C 108.379 -1.889 . . . . 0.0 108.379 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.4 ' O ' ' C ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -54.12 -41.64 51.9 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.825 0 O-C-N 122.003 -0.704 . . . . 0.0 110.499 179.189 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.486 ' CD ' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -41.12 -59.45 1.49 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.675 -0.641 . . . . 0.0 112.069 -177.776 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.67 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 4.1 p90 -91.28 -28.58 17.68 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.279 -1.513 . . . . 0.0 111.293 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.67 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -53.9 -44.06 70.2 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.522 -1.362 . . . . 0.0 109.44 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.514 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -71.16 -52.09 21.17 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.643 1.211 . . . . 0.0 110.087 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 50' ' ' TYR . 44.8 mttt -58.89 -52.53 65.34 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.729 -179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 46.4 mt -51.44 -27.78 11.23 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 120.733 -1.23 . . . . 0.0 110.836 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.514 ' HB ' ' O ' ' A' ' 52' ' ' ALA 0.331 0.3 OUTLIER -75.21 -55.21 12.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 CA-C-O 121.591 0.71 . . . . 0.0 110.15 -179.89 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.466 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 110.35 51.5 0.62 Allowed Glycine 0 C--N 1.3 -1.464 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.47 ' CG2' HG23 ' A' ' 55' ' ' ILE 0.262 2.4 pt -72.68 -119.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.232 0 CA-C-O 122.527 1.156 . . . . 0.0 110.271 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.443 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 27.0 t0 . . . . . 0 C--N 1.26 -3.291 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.452 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.439 ' O ' ' C ' ' A' ' 25' ' ' LYS . 13.5 p . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.142 0.496 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' A' ' 26' ' ' LYS . 2.2 tmtm? -41.28 -57.54 2.1 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.335 -0.853 . . . . 0.0 110.316 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.475 ' O ' ' O ' ' A' ' 27' ' ' GLU . 0.2 OUTLIER 49.4 -179.1 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.17 -0.956 . . . . 0.0 109.957 179.63 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 26' ' ' LYS . 1.7 tt0 -52.19 -172.16 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.211 -0.931 . . . . 0.0 109.772 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.522 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -41.08 163.33 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.263 -0.898 . . . . 0.0 110.177 179.716 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 tttp -64.56 58.43 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.194 -0.942 . . . . 0.0 111.05 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 28' ' ' LYS . 14.6 ptpt -50.35 150.51 2.53 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.068 -1.02 . . . . 0.0 110.717 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -56.2 -160.58 0.02 OUTLIER Glycine 0 N--CA 1.483 1.771 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.513 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.2 Cg_endo -65.16 -164.98 0.07 OUTLIER 'Trans proline' 0 C--N 1.301 -1.938 0 O-C-N 124.31 1.689 . . . . 0.0 111.065 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.446 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.6 9.34 16.36 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.908 1.337 . . . . 0.0 111.039 -178.827 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.537 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.262 0.0 OUTLIER -60.72 161.22 8.17 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.22 179.352 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.617 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -163.79 -26.66 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.724 -1.235 . . . . 0.0 112.402 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -97.17 -70.55 0.71 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.794 -1.191 . . . . 0.0 110.104 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.1 -13.78 50.13 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.968 0.889 . . . . 0.0 109.022 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.617 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.88 -19.52 48.06 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.186 -179.434 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.598 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -49.31 -55.69 11.98 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 120.804 -1.185 . . . . 0.0 108.793 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.608 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.3 mm? -59.19 -25.76 64.23 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.932 0.872 . . . . 0.0 109.341 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.519 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -54.3 -37.58 64.95 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 120.957 -1.09 . . . . 0.0 108.197 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' LYS . 18.3 mmm180 -90.23 -18.33 25.88 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.412 0.625 . . . . 0.0 111.187 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.585 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.1 m-85 -43.33 -23.12 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.311 -0.868 . . . . 0.0 110.799 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.53 12.81 0.56 Allowed 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.108 -0.995 . . . . 0.0 112.441 -178.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.497 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -74.0 -84.16 0.31 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 110.089 -1.204 . . . . 0.0 110.089 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.494 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -94.25 59.39 2.61 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.617 0.722 . . . . 0.0 109.484 -179.896 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.542 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -139.83 -76.98 0.05 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.403 ' O ' ' C ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -53.19 -45.06 54.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 O-C-N 122.094 -0.65 . . . . 0.0 110.702 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.2 OUTLIER -41.64 -59.35 1.66 Allowed 'General case' 0 C--N 1.297 -1.698 0 O-C-N 121.458 -0.776 . . . . 0.0 111.59 -178.333 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.66 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.5 p90 -92.77 -26.69 17.61 Favored 'General case' 0 C--N 1.307 -1.262 0 O-C-N 120.307 -1.496 . . . . 0.0 110.719 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.66 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 4.0 mmtt -48.82 -47.71 42.19 Favored 'General case' 0 C--N 1.305 -1.334 0 O-C-N 120.834 -1.166 . . . . 0.0 109.306 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.508 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -62.03 -54.45 41.37 Favored 'General case' 0 C--N 1.286 -2.192 0 CA-C-O 122.43 1.109 . . . . 0.0 109.89 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -53.29 59.87 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.228 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 31.3 mt -51.3 -28.36 11.86 Favored 'General case' 0 C--N 1.308 -1.214 0 O-C-N 120.88 -1.137 . . . . 0.0 110.503 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.508 ' HB ' ' O ' ' A' ' 52' ' ' ALA 0.331 0.2 OUTLIER -75.25 -56.71 7.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 CA-C-O 121.552 0.691 . . . . 0.0 110.029 179.654 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.468 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 123.65 50.2 0.21 Allowed Glycine 0 C--N 1.302 -1.357 0 N-CA-C 110.236 -1.146 . . . . 0.0 110.236 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.451 HG21 ' O ' ' A' ' 52' ' ' ALA 0.259 3.5 pt -73.93 -119.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.168 0 CA-C-O 122.602 1.192 . . . . 0.0 110.239 179.734 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.409 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 3.7 t0 . . . . . 0 C--N 1.26 -3.311 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.105 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 25' ' ' LYS . 94.7 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.192 0.52 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.447 ' O ' ' O ' ' A' ' 24' ' ' SER . 0.0 OUTLIER 54.54 166.26 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.308 -0.87 . . . . 0.0 110.239 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 27' ' ' GLU . 1.3 mmtt -52.51 178.1 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.283 -0.885 . . . . 0.0 110.548 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.462 ' O ' ' O ' ' A' ' 26' ' ' LYS . 0.9 OUTLIER 56.82 119.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.533 -0.73 . . . . 0.0 110.952 179.539 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.474 ' O ' ' O ' ' A' ' 29' ' ' LYS . 10.0 tptp -50.01 179.6 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.472 -0.767 . . . . 0.0 110.458 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.538 ' O ' ' N ' ' A' ' 31' ' ' GLY . 1.9 ttpm? -38.06 160.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.604 -0.685 . . . . 0.0 110.742 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 31' ' ' GLY . 7.6 mmtt -42.32 91.87 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.35 -0.844 . . . . 0.0 110.529 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.538 ' N ' ' O ' ' A' ' 29' ' ' LYS . . . -52.15 -173.28 0.03 OUTLIER Glycine 0 N--CA 1.485 1.9 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.53 -170.09 0.24 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.075 1.566 . . . . 0.0 110.734 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.517 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -91.18 7.3 41.36 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 123.234 1.492 . . . . 0.0 110.271 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.526 ' NZ ' ' HB2' ' A' ' 37' ' ' GLU 0.259 0.3 OUTLIER -73.44 138.08 44.96 Favored 'General case' 0 C--N 1.263 -3.166 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.446 179.742 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.594 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -170.76 -25.99 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.257 -0.902 . . . . 0.0 111.403 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -102.79 -69.74 0.78 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.139 -0.976 . . . . 0.0 109.059 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.526 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 4.7 mt-10 -63.13 -15.1 55.66 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.594 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.73 -19.52 52.16 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.326 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.585 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -45.64 -56.35 5.3 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.121 -0.987 . . . . 0.0 109.541 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.603 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.2 mm? -62.73 -37.94 88.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' A' ' 38' ' ' TYR . . . -45.81 -39.28 8.18 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.823 -1.173 . . . . 0.0 108.792 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.445 ' HD3' ' HB2' ' A' ' 46' ' ' ASP . 8.0 mtt180 -91.0 -17.21 26.66 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.714 -0.616 . . . . 0.0 111.767 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.582 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.5 m-85 -44.16 -42.28 6.3 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.217 -0.927 . . . . 0.0 110.96 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -73.34 12.93 0.5 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.191 -0.943 . . . . 0.0 112.966 -178.58 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -160.27 -96.66 0.11 Allowed Glycine 0 C--N 1.286 -2.217 0 C-N-CA 120.013 -1.089 . . . . 0.0 110.404 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.619 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 5.9 m-20 -75.55 36.44 0.13 Allowed 'General case' 0 C--N 1.296 -1.735 0 O-C-N 121.617 -0.931 . . . . 0.0 112.011 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.603 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -88.57 -50.12 3.45 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -57.45 -46.07 85.74 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.214 0 CA-C-N 114.763 -0.718 . . . . 0.0 110.884 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.56 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -42.92 -59.39 2.01 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.394 -0.816 . . . . 0.0 112.436 -178.144 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.679 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 7.3 p90 -81.04 -36.05 31.05 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 120.349 -1.469 . . . . 0.0 111.145 -179.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.679 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -54.4 -45.31 72.88 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.24 -1.538 . . . . 0.0 108.749 178.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.512 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -64.19 -53.28 51.83 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.462 1.125 . . . . 0.0 110.534 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -67.22 -51.04 58.14 Favored 'General case' 0 C--N 1.283 -2.316 0 CA-C-N 115.228 -0.896 . . . . 0.0 112.098 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 40.9 mt -50.84 -21.23 1.58 Allowed 'General case' 0 C--N 1.308 -1.224 0 O-C-N 120.759 -1.213 . . . . 0.0 110.947 -178.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.597 ' CG2' ' CG2' ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -74.88 -56.43 8.92 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.984 0 CA-C-O 121.601 0.715 . . . . 0.0 109.526 179.445 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.468 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 85.79 53.58 2.99 Favored Glycine 0 N--CA 1.477 1.416 0 C-N-CA 119.983 -1.103 . . . . 0.0 111.113 178.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.597 ' CG2' ' CG2' ' A' ' 55' ' ' ILE 0.253 1.9 pt -70.85 -118.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.223 0 CA-C-O 122.611 1.196 . . . . 0.0 109.918 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.432 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 6.3 t70 . . . . . 0 C--N 1.258 -3.373 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.267 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.7 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.421 0.629 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.457 ' O ' ' O ' ' A' ' 26' ' ' LYS . 0.8 OUTLIER -65.2 -9.8 26.34 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.221 -0.925 . . . . 0.0 110.698 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.461 ' HB3' ' OE2' ' A' ' 27' ' ' GLU . 0.7 OUTLIER -49.83 -177.88 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.909 . . . . 0.0 110.769 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.461 ' OE2' ' HB3' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -43.25 141.86 1.18 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.39 -0.819 . . . . 0.0 110.891 -179.607 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -59.92 -166.05 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.281 -0.887 . . . . 0.0 110.645 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -44.96 174.05 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.432 -0.792 . . . . 0.0 110.622 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 29' ' ' LYS . 1.7 mttm -47.33 173.79 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.239 -0.913 . . . . 0.0 110.011 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -178.32 -179.59 48.3 Favored Glycine 0 N--CA 1.474 1.217 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -69.06 163.08 39.09 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 O-C-N 123.939 1.494 . . . . 0.0 110.848 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.97 12.63 33.56 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 123.155 1.455 . . . . 0.0 109.848 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.548 ' CD ' ' HB3' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -61.49 158.39 14.99 Favored 'General case' 0 C--N 1.267 -3.0 0 CA-C-N 113.925 -1.489 . . . . 0.0 110.52 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.621 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.53 -24.92 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 O-C-N 121.028 -1.045 . . . . 0.0 112.395 179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 m-20 -100.2 -70.41 0.74 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.814 -1.179 . . . . 0.0 109.873 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -62.83 -15.1 52.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-O 122.071 0.938 . . . . 0.0 108.663 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.621 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.93 -19.27 52.21 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.348 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.589 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.06 -56.96 4.2 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.211 -0.931 . . . . 0.0 109.48 178.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.598 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.4 mm? -62.51 -37.99 88.19 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.614 0.721 . . . . 0.0 109.869 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.43 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -47.34 -37.12 10.44 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.718 -1.239 . . . . 0.0 108.461 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -19.25 23.94 Favored 'General case' 0 C--N 1.308 -1.196 0 O-C-N 121.739 -0.601 . . . . 0.0 111.5 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.569 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.5 m-30 -43.92 -44.05 6.85 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.253 -0.904 . . . . 0.0 110.436 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.618 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.6 mptm? -74.42 13.32 0.61 Allowed 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.251 -0.906 . . . . 0.0 112.321 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.508 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -52.66 -82.03 0.05 OUTLIER Glycine 0 N--CA 1.489 2.218 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.77 65.04 0.99 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-O 121.848 0.832 . . . . 0.0 109.97 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.525 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -145.12 -69.35 0.02 OUTLIER Glycine 0 N--CA 1.486 2.031 0 N-CA-C 108.389 -1.885 . . . . 0.0 108.389 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.463 ' CG1' ' HB3' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -66.78 -46.82 84.61 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.949 0 O-C-N 122.344 -0.504 . . . . 0.0 111.864 -179.735 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -42.03 -59.37 1.77 Allowed 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.052 -1.03 . . . . 0.0 112.173 -177.526 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.681 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.1 p90 -80.54 -30.59 37.11 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.429 -1.419 . . . . 0.0 110.615 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.681 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -51.95 -54.22 32.06 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 120.523 -1.361 . . . . 0.0 108.671 178.834 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.497 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -55.35 -54.12 47.65 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-O 122.38 1.086 . . . . 0.0 110.246 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.8 mttt -64.15 -54.12 38.77 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.574 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 43.6 mt -50.56 -25.75 4.47 Favored 'General case' 0 C--N 1.31 -1.134 0 O-C-N 120.686 -1.259 . . . . 0.0 110.044 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.584 HG23 ' CG2' ' A' ' 57' ' ' ILE 0.344 0.3 OUTLIER -75.51 -64.24 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.815 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.555 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 62.76 43.03 99.56 Favored Glycine 0 N--CA 1.481 1.675 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 178.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.584 ' CG2' HG23 ' A' ' 55' ' ' ILE 0.254 3.1 pt -71.96 -117.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.284 -2.255 0 CA-C-O 122.512 1.148 . . . . 0.0 109.755 178.735 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.437 ' OXT' ' CG ' ' A' ' 58' ' ' ASP . 23.4 t70 . . . . . 0 C--N 1.258 -3.395 0 CA-C-O 117.948 -1.025 . . . . 0.0 109.989 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.464 ' O ' ' N ' ' A' ' 26' ' ' LYS . 4.7 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.348 0.594 . . . . 0.0 110.083 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 24' ' ' SER . 0.0 OUTLIER 65.51 -66.92 0.14 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.386 -0.821 . . . . 0.0 110.509 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.464 ' N ' ' O ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -128.6 146.54 50.82 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.179 -0.951 . . . . 0.0 110.411 -179.804 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 26' ' ' LYS . 21.6 tt0 -179.06 -50.0 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.386 -0.821 . . . . 0.0 109.89 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -41.96 145.12 0.36 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.377 -0.827 . . . . 0.0 110.284 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 28' ' ' LYS . 38.0 ttpt -41.63 123.22 2.17 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.396 -0.815 . . . . 0.0 110.063 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 31' ' ' GLY . 6.5 mttt -39.56 111.28 0.18 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.522 -0.737 . . . . 0.0 110.776 -179.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -54.61 -161.56 0.01 OUTLIER Glycine 0 N--CA 1.484 1.872 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -66.26 -173.17 0.33 Allowed 'Trans proline' 0 C--N 1.3 -1.987 0 O-C-N 124.109 1.584 . . . . 0.0 110.739 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.448 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.88 13.79 19.41 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 123.141 1.448 . . . . 0.0 109.841 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.553 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -64.12 153.29 38.12 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.702 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.625 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -159.64 -29.18 0.07 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.154 -0.966 . . . . 0.0 111.705 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.449 ' O ' HD22 ' A' ' 39' ' ' LEU . 1.5 t0 -93.43 -69.82 0.73 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.161 -0.962 . . . . 0.0 109.829 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 0.8 OUTLIER -64.19 -13.64 49.98 Favored 'General case' 0 C--N 1.287 -2.144 0 CA-C-O 121.902 0.858 . . . . 0.0 109.152 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -82.84 -17.83 42.54 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 121.308 0.575 . . . . 0.0 110.076 -179.816 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.561 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -47.72 -55.59 9.2 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.212 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.598 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.4 mm? -58.67 -33.55 70.25 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-O 121.963 0.887 . . . . 0.0 109.095 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.493 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -48.67 -43.05 36.5 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.978 -1.076 . . . . 0.0 108.299 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 44' ' ' LYS . 2.1 mmp_? -90.61 -16.58 28.42 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.733 -0.604 . . . . 0.0 111.591 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.578 ' CG ' ' HA ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -42.35 -24.48 0.05 Allowed 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 110.793 -179.051 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -70.93 12.87 0.23 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.092 -1.005 . . . . 0.0 112.897 -178.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.402 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -126.28 -104.09 1.37 Allowed Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.612 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 1.5 m-20 -82.15 35.63 0.44 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.374 -1.074 . . . . 0.0 110.819 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.59 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -89.82 -51.84 2.75 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 108.552 -1.819 . . . . 0.0 108.552 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -52.78 -45.87 50.35 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.081 0 CA-C-N 114.948 -0.626 . . . . 0.0 110.536 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.507 ' HD2' ' O ' ' A' ' 46' ' ' ASP . 0.3 OUTLIER -43.84 -59.24 2.34 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 111.872 -178.255 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.675 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.4 p90 -89.3 -28.71 19.68 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.514 -1.366 . . . . 0.0 111.276 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.675 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -47.38 -55.78 8.21 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.698 -1.251 . . . . 0.0 109.225 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.489 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -51.94 -54.05 34.06 Favored 'General case' 0 C--N 1.284 -2.26 0 CA-C-O 122.505 1.145 . . . . 0.0 110.117 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.4 mttt -63.57 -53.1 56.98 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.719 -178.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.576 HD11 ' CD1' ' A' ' 50' ' ' TYR . 28.5 mt -50.29 -25.73 4.05 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 120.67 -1.269 . . . . 0.0 110.179 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.585 HG21 ' CG2' ' A' ' 57' ' ' ILE 0.339 0.3 OUTLIER -76.05 -65.76 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.864 0 CA-C-O 121.634 0.73 . . . . 0.0 109.142 178.831 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.561 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 56.96 41.7 92.24 Favored Glycine 0 N--CA 1.483 1.772 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 178.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.585 ' CG2' HG21 ' A' ' 55' ' ' ILE 0.252 3.3 pt -72.58 -118.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.283 -2.32 0 CA-C-O 122.575 1.179 . . . . 0.0 109.928 179.177 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.432 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 16.2 t0 . . . . . 0 C--N 1.259 -3.354 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.22 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 121.272 0.558 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.9 -67.73 0.26 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.222 -0.924 . . . . 0.0 110.273 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 27' ' ' GLU . 6.2 ttmt 54.84 35.15 23.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.193 -0.942 . . . . 0.0 110.262 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -40.45 -30.45 0.11 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.419 -0.8 . . . . 0.0 110.665 -179.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.537 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -56.41 126.33 25.95 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.253 -0.904 . . . . 0.0 110.56 -179.734 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.537 ' C ' ' O ' ' A' ' 28' ' ' LYS . 6.9 ttmt 25.57 63.31 0.06 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.331 0.586 . . . . 0.0 111.303 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.551 ' CG ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -63.77 60.66 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.5 -0.75 . . . . 0.0 111.244 -179.218 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 29' ' ' LYS . . . 49.04 -152.63 2.8 Favored Glycine 0 N--CA 1.485 1.908 0 C-N-CA 119.705 -1.236 . . . . 0.0 110.125 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.491 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.0 Cg_endo -63.45 -161.71 0.04 OUTLIER 'Trans proline' 0 C--N 1.3 -2.004 0 O-C-N 124.517 1.798 . . . . 0.0 111.602 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -79.32 2.38 21.69 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.909 1.338 . . . . 0.0 111.503 -178.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.524 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.251 0.1 OUTLIER -66.15 149.28 50.55 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.762 178.968 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.621 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.25 -24.87 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.993 -1.067 . . . . 0.0 112.226 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -97.2 -70.08 0.73 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.97 -1.081 . . . . 0.0 109.722 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -13.12 57.11 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 121.914 0.864 . . . . 0.0 109.031 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.621 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -81.2 -19.11 43.98 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.113 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -50.31 -56.64 10.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.009 -1.057 . . . . 0.0 109.406 179.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.603 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.3 mm? -63.33 -32.25 73.61 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.461 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -45.42 -37.45 5.11 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.877 -1.139 . . . . 0.0 108.883 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.43 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -90.29 -18.58 25.35 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.645 -0.659 . . . . 0.0 111.5 -179.866 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.594 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.6 m-85 -44.29 -33.79 1.72 Allowed 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.093 -1.004 . . . . 0.0 110.101 -179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.617 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 9.6 mptt -77.51 12.18 1.7 Allowed 'General case' 0 C--N 1.308 -1.201 0 O-C-N 121.163 -0.96 . . . . 0.0 112.079 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -115.05 -100.72 2.32 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.618 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 5.7 m-20 -82.24 33.13 0.39 Allowed 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.509 -0.995 . . . . 0.0 110.473 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.592 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -87.46 -51.89 3.17 Favored Glycine 0 N--CA 1.485 1.933 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.417 ' O ' ' C ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -52.26 -46.78 45.52 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.193 0 CA-C-N 114.972 -0.614 . . . . 0.0 110.288 179.726 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.521 ' CG ' ' O ' ' A' ' 46' ' ' ASP . 2.3 ptpt -43.09 -59.09 2.17 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.266 -0.896 . . . . 0.0 111.536 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.629 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.4 p90 -91.1 -26.36 19.16 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.518 -1.364 . . . . 0.0 111.128 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.629 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -47.92 -53.54 15.56 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.546 -1.346 . . . . 0.0 109.017 179.585 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.488 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -55.98 -53.36 57.87 Favored 'General case' 0 C--N 1.285 -2.237 0 CA-C-O 122.584 1.183 . . . . 0.0 109.987 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.469 ' HA ' HG12 ' A' ' 57' ' ' ILE . 3.1 mtpm? -61.16 -54.03 49.58 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.514 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.572 HD12 ' CD1' ' A' ' 50' ' ' TYR . 26.5 mt -51.3 -27.06 8.46 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 120.687 -1.258 . . . . 0.0 110.542 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.488 ' HB ' ' O ' ' A' ' 52' ' ' ALA 0.326 0.2 OUTLIER -75.17 -57.63 6.06 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.434 0.635 . . . . 0.0 110.223 179.817 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.471 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 134.12 51.64 0.08 OUTLIER Glycine 0 C--N 1.302 -1.344 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 53' ' ' LYS 0.262 4.8 pt -74.68 -120.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.2 0 CA-C-O 122.649 1.214 . . . . 0.0 110.307 -179.912 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.434 ' C ' ' O ' ' A' ' 57' ' ' ILE . 48.6 t0 . . . . . 0 C--N 1.261 -3.24 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.444 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.281 0.562 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.9 tmtp? 57.76 36.99 27.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.298 -0.876 . . . . 0.0 110.513 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.55 129.61 16.37 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.313 -0.867 . . . . 0.0 110.56 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 28' ' ' LYS . 3.2 mt-10 -53.95 -84.52 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.358 -0.839 . . . . 0.0 110.792 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.408 ' C ' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -42.13 134.08 2.88 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.287 -0.883 . . . . 0.0 111.031 -179.376 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.85 127.04 7.79 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 121.43 -0.794 . . . . 0.0 110.359 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -50.73 142.71 10.82 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.222 -0.924 . . . . 0.0 110.422 179.925 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 176.85 -172.59 45.55 Favored Glycine 0 N--CA 1.474 1.178 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -67.47 163.8 33.35 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.056 1.556 . . . . 0.0 111.167 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.472 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.9 9.93 28.44 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 123.038 1.399 . . . . 0.0 110.242 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.529 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -60.75 151.51 29.31 Favored 'General case' 0 C--N 1.267 -2.983 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.844 179.298 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.602 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.49 -23.15 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.987 -1.07 . . . . 0.0 112.563 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -99.59 -70.07 0.74 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.76 -1.212 . . . . 0.0 109.868 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.89 -13.95 58.17 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-O 121.992 0.901 . . . . 0.0 108.774 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.609 ' CD1' ' N ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -79.5 -19.45 49.66 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.719 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.609 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -48.92 -56.99 7.18 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.173 -0.954 . . . . 0.0 109.364 179.429 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.592 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.5 mm? -61.8 -32.35 72.64 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.666 0.746 . . . . 0.0 110.001 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.45 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -45.55 -36.92 4.95 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 120.943 -1.098 . . . . 0.0 108.814 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.3 OUTLIER -90.53 -19.83 23.34 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.627 -0.671 . . . . 0.0 111.644 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.583 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.2 m-85 -41.98 -41.8 2.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.214 -0.929 . . . . 0.0 110.45 -179.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.616 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.87 12.98 0.57 Allowed 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.019 -1.051 . . . . 0.0 112.364 -179.32 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -87.42 -99.81 0.87 Allowed Glycine 0 C--N 1.288 -2.096 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.634 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 1.6 m-20 -81.14 38.69 0.48 Allowed 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.529 -0.983 . . . . 0.0 110.817 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -100.51 -63.07 0.79 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -51.07 -43.16 25.92 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.124 0 CA-C-O 121.561 0.696 . . . . 0.0 110.395 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.575 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 2.4 ptpt -42.46 -59.55 1.83 Allowed 'General case' 0 C--N 1.296 -1.756 0 O-C-N 121.549 -0.72 . . . . 0.0 111.96 -178.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.659 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 2.6 p90 -86.25 -28.01 24.07 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.471 -1.393 . . . . 0.0 110.391 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.659 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 1.6 mmtp -55.16 -44.44 75.17 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 120.928 -1.107 . . . . 0.0 108.803 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -65.57 -55.07 19.67 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 122.308 1.051 . . . . 0.0 110.014 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -61.01 -54.13 48.65 Favored 'General case' 0 C--N 1.287 -2.143 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.231 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 44.9 mt -51.6 -29.4 17.27 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.816 -1.177 . . . . 0.0 110.26 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.563 ' CG2' ' CG2' ' A' ' 57' ' ' ILE 0.335 0.3 OUTLIER -76.06 -57.67 5.77 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 CA-C-O 121.63 0.728 . . . . 0.0 109.857 179.58 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.526 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 105.65 50.57 0.9 Allowed Glycine 0 C--N 1.302 -1.324 0 N-CA-C 110.241 -1.143 . . . . 0.0 110.241 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.563 ' CG2' ' CG2' ' A' ' 55' ' ' ILE 0.263 1.4 pt -76.93 -120.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.289 -2.064 0 CA-C-O 122.637 1.208 . . . . 0.0 110.127 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' A' ' 57' ' ' ILE . 3.1 t70 . . . . . 0 C--N 1.259 -3.337 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.11 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.433 ' O ' ' N ' ' A' ' 26' ' ' LYS . 2.0 t . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.246 0.546 . . . . 0.0 110.188 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -51.45 92.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.877 . . . . 0.0 110.604 -179.798 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -57.35 -155.86 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.223 -0.923 . . . . 0.0 110.141 179.76 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 26' ' ' LYS . 0.6 OUTLIER 177.28 88.46 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.23 -0.919 . . . . 0.0 110.485 179.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.522 ' HD3' ' N ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -67.67 -12.65 60.96 Favored 'General case' 0 C--N 1.306 -1.315 0 O-C-N 121.256 -0.902 . . . . 0.0 110.94 -179.858 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.477 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 16.3 mttt -44.22 110.95 0.25 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.09 -1.006 . . . . 0.0 110.459 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 31' ' ' GLY . 6.5 mttp -53.99 -167.83 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.367 -0.833 . . . . 0.0 110.477 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -53.28 -167.3 0.02 OUTLIER Glycine 0 N--CA 1.485 1.935 0 N-CA-C 110.244 -1.143 . . . . 0.0 110.244 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -66.82 155.02 72.51 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 O-C-N 124.106 1.582 . . . . 0.0 111.036 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.92 7.46 34.37 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 123.01 1.386 . . . . 0.0 110.368 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.517 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.256 0.2 OUTLIER -69.7 159.97 32.52 Favored 'General case' 0 C--N 1.266 -3.062 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.191 179.641 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.625 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -167.88 -28.64 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 O-C-N 120.922 -1.111 . . . . 0.0 111.803 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 8.9 t70 -94.78 -70.25 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.063 -1.023 . . . . 0.0 109.97 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.457 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -63.52 -14.47 51.44 Favored 'General case' 0 C--N 1.283 -2.301 0 CA-C-O 122.041 0.924 . . . . 0.0 109.091 178.719 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -82.04 -18.15 44.24 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.088 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.575 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -46.16 -57.11 4.8 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.353 -0.842 . . . . 0.0 109.46 179.074 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.596 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.3 mm? -61.13 -37.93 84.57 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.565 -0.709 . . . . 0.0 109.876 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -43.72 -35.48 1.85 Allowed 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.053 -1.029 . . . . 0.0 108.746 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 43' ' ' PHE . 24.7 mtp180 -91.71 -17.62 25.18 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 121.822 -0.549 . . . . 0.0 112.079 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.59 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -40.12 -61.67 0.85 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.156 -0.965 . . . . 0.0 111.027 -178.465 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.1 mptm? -77.48 13.77 1.15 Allowed 'General case' 0 C--N 1.309 -1.168 0 O-C-N 121.143 -0.973 . . . . 0.0 112.498 -179.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.464 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -91.94 -100.54 1.34 Allowed Glycine 0 C--N 1.287 -2.167 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.493 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -106.9 62.71 0.63 Allowed 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.794 -0.827 . . . . 0.0 109.733 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.546 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -145.58 -83.02 0.05 OUTLIER Glycine 0 N--CA 1.485 1.937 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 43' ' ' PHE . 0.2 OUTLIER -50.92 -46.1 29.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 121.985 -0.714 . . . . 0.0 110.848 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.493 ' HD2' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -42.15 -59.21 1.85 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.525 -0.734 . . . . 0.0 111.947 -177.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.691 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.1 p90 -91.26 -27.61 18.32 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 120.363 -1.46 . . . . 0.0 111.019 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.691 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -46.59 -56.82 5.46 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.664 -1.272 . . . . 0.0 109.67 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.505 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -52.75 -54.24 36.7 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-O 122.399 1.095 . . . . 0.0 110.66 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.4 mttm -65.78 -52.55 49.92 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.92 -178.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.576 HD12 ' CD1' ' A' ' 50' ' ' TYR . 30.4 mt -50.87 -22.88 2.42 Favored 'General case' 0 C--N 1.308 -1.214 0 O-C-N 120.709 -1.245 . . . . 0.0 110.792 -179.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.529 HG23 ' CG2' ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -75.31 -57.88 5.58 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.885 0 CA-C-O 121.539 0.685 . . . . 0.0 109.535 179.642 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.469 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 124.27 43.6 0.32 Allowed Glycine 0 N--CA 1.475 1.25 0 C-N-CA 120.077 -1.059 . . . . 0.0 110.864 179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.529 ' CG2' HG23 ' A' ' 55' ' ' ILE 0.268 1.7 pt -83.88 -123.68 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.235 0 CA-C-O 122.676 1.227 . . . . 0.0 109.944 179.361 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.433 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 6.3 t0 . . . . . 0 C--N 1.261 -3.274 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.447 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.349 0.595 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -44.46 116.9 1.13 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.404 -0.81 . . . . 0.0 110.724 -179.664 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.471 ' O ' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -68.85 59.16 0.09 Allowed 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.263 -0.898 . . . . 0.0 110.497 179.934 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.477 ' O ' ' N ' ' A' ' 29' ' ' LYS . 4.1 tp10 56.15 157.2 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.345 -0.847 . . . . 0.0 110.607 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -47.84 91.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.301 -0.874 . . . . 0.0 110.737 -179.752 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 27' ' ' GLU . 2.8 ttmt -44.47 138.56 3.17 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.112 -0.993 . . . . 0.0 109.998 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.408 ' O ' ' O ' ' A' ' 31' ' ' GLY . 14.0 mtmt -49.54 165.12 0.07 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.231 -0.918 . . . . 0.0 110.731 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.408 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 45.9 -169.39 0.03 OUTLIER Glycine 0 N--CA 1.488 2.137 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.9 163.22 36.44 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.165 1.613 . . . . 0.0 110.859 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.441 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -94.03 6.88 47.11 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 122.918 1.342 . . . . 0.0 110.532 -179.562 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.534 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.252 0.0 OUTLIER -75.96 142.89 41.86 Favored 'General case' 0 C--N 1.264 -3.149 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.588 179.918 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.591 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -169.05 -25.32 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.267 -0.896 . . . . 0.0 111.618 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.05 -70.38 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.98 -1.075 . . . . 0.0 109.419 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.404 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -65.47 -13.56 59.06 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.038 0.923 . . . . 0.0 108.545 178.118 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.599 ' CD1' ' N ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -77.12 -19.9 56.36 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.131 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -50.87 -56.53 11.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.28 -0.887 . . . . 0.0 109.357 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.603 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.2 mm? -61.73 -35.17 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.116 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.469 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -43.14 -36.9 1.84 Allowed 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.054 -1.029 . . . . 0.0 109.009 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.4 mtp180 -90.69 -19.57 23.45 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.627 -0.67 . . . . 0.0 111.806 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.603 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.6 m-85 -42.24 -48.88 5.0 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.142 -0.974 . . . . 0.0 110.627 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.2 mptp? -73.62 13.42 0.48 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.17 -0.957 . . . . 0.0 112.822 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.89 -12.77 48.87 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.547 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -86.4 49.15 1.74 Allowed 'General case' 0 C--N 1.287 -2.122 0 O-C-N 121.766 -0.844 . . . . 0.0 110.116 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -112.8 -73.8 0.65 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -51.74 -40.28 26.41 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.938 0 CA-C-O 121.628 0.727 . . . . 0.0 110.625 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.5 ' HD2' ' CA ' ' A' ' 46' ' ' ASP . 3.2 ptpt -41.04 -59.55 1.44 Allowed 'General case' 0 C--N 1.295 -1.795 0 O-C-N 121.728 -0.607 . . . . 0.0 112.128 -177.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.653 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 3.4 p90 -92.5 -28.38 16.84 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 120.338 -1.476 . . . . 0.0 111.125 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.653 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -58.79 -40.66 84.66 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 120.603 -1.311 . . . . 0.0 109.42 179.589 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.468 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -71.48 -54.71 9.7 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-O 122.395 1.093 . . . . 0.0 110.332 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.6 mttt -60.96 -53.13 61.01 Favored 'General case' 0 C--N 1.285 -2.238 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.877 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 52.7 mt -51.14 -28.24 10.45 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.94 -1.1 . . . . 0.0 110.567 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.551 ' CG2' ' CG2' ' A' ' 57' ' ' ILE 0.332 0.3 OUTLIER -75.9 -57.19 6.6 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.843 0 CA-C-O 121.629 0.728 . . . . 0.0 109.895 179.771 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.502 ' N ' HG23 ' A' ' 55' ' ' ILE . . . 101.89 51.85 1.06 Allowed Glycine 0 C--N 1.302 -1.323 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.551 ' CG2' ' CG2' ' A' ' 55' ' ' ILE 0.259 4.4 pt -74.06 -120.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.208 0 CA-C-O 122.654 1.216 . . . . 0.0 110.316 179.838 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.43 ' OD1' ' O ' ' A' ' 58' ' ' ASP . 46.6 t0 . . . . . 0 C--N 1.259 -3.327 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.395 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.409 ' O ' ' C ' ' A' ' 25' ' ' LYS . 75.4 m . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 121.292 0.568 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.409 ' C ' ' O ' ' A' ' 24' ' ' SER . 31.1 mtpt -42.79 152.16 0.11 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 0.0 110.468 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.78 135.94 46.92 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.0 110.91 -179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.79 108.09 0.32 Allowed 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.3 -0.875 . . . . 0.0 110.556 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.97 96.85 0.15 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.117 -0.989 . . . . 0.0 110.474 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 tttt -47.14 151.4 0.68 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.259 -0.901 . . . . 0.0 110.596 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.458 ' O ' ' O ' ' A' ' 31' ' ' GLY . 16.0 mttp -75.62 99.59 4.35 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.248 -0.907 . . . . 0.0 110.506 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -43.6 167.09 0.02 OUTLIER Glycine 0 N--CA 1.487 2.034 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -71.04 146.53 52.54 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 O-C-N 124.232 1.648 . . . . 0.0 110.927 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.527 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -98.81 7.52 45.97 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 123.166 1.46 . . . . 0.0 110.201 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.543 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 1.7 mmtp -69.37 153.6 43.33 Favored 'General case' 0 C--N 1.265 -3.086 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.596 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.605 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -165.66 -24.65 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.139 -0.976 . . . . 0.0 112.113 179.719 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 23.3 t0 -101.37 -69.76 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.717 -1.239 . . . . 0.0 109.276 179.161 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.2 -14.88 54.13 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 178.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.605 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.17 -19.54 50.68 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.69 -56.41 4.45 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.158 -0.964 . . . . 0.0 109.424 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.597 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.6 mm? -59.33 -32.39 70.05 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.848 0.832 . . . . 0.0 109.456 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.446 ' HB2' ' O ' ' A' ' 38' ' ' TYR . . . -57.61 -41.48 81.37 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.497 ' O ' ' N ' ' A' ' 44' ' ' LYS . 16.3 mmt180 -90.18 -16.7 28.96 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.435 0.636 . . . . 0.0 111.205 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.573 ' CG ' ' HA ' ' A' ' 40' ' ' LEU . 0.7 OUTLIER -39.77 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.474 -0.766 . . . . 0.0 111.318 -179.033 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.597 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.7 OUTLIER -74.1 12.83 0.64 Allowed 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.85 -1.156 . . . . 0.0 112.378 -179.198 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.494 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -42.65 -69.87 0.56 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.5 59.87 0.06 Allowed 'General case' 0 C--N 1.288 -2.085 0 CA-C-O 121.86 0.838 . . . . 0.0 109.422 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.464 ' HA2' ' OH ' ' A' ' 50' ' ' TYR . . . -140.23 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.316 -1.514 . . . . 0.0 109.316 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.4 ' O ' ' C ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -62.99 -44.12 99.48 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.771 0 O-C-N 121.943 -0.74 . . . . 0.0 111.592 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -40.65 -58.87 1.51 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.208 -0.932 . . . . 0.0 111.966 -177.616 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.656 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 4.6 p90 -83.09 -28.15 29.71 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.385 -1.447 . . . . 0.0 110.77 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.656 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -61.07 -42.08 97.82 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.505 -1.372 . . . . 0.0 108.756 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.478 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -71.5 -54.99 8.75 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-O 122.414 1.102 . . . . 0.0 110.188 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -58.9 -53.71 55.36 Favored 'General case' 0 C--N 1.286 -2.177 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.862 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 58.5 mt -50.29 -30.96 13.04 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 120.837 -1.164 . . . . 0.0 109.786 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.601 HG22 ' CG2' ' A' ' 57' ' ' ILE 0.347 0.3 OUTLIER -75.94 -65.05 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.259 179.131 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.555 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 61.65 41.08 99.53 Favored Glycine 0 N--CA 1.481 1.689 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.601 ' CG2' HG22 ' A' ' 55' ' ' ILE 0.254 4.8 pt -75.43 -120.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.284 -2.26 0 CA-C-O 122.656 1.217 . . . . 0.0 109.796 178.816 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.443 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--N 1.26 -3.292 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.47 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.434 ' O ' ' C ' ' A' ' 25' ' ' LYS . 9.7 t . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.104 0.478 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.484 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -41.96 150.49 0.12 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 25' ' ' LYS . 34.5 ttmt 179.48 -49.8 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.358 -0.839 . . . . 0.0 110.035 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.5 ' O ' ' N ' ' A' ' 29' ' ' LYS . 31.0 tt0 40.53 86.27 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.509 -0.745 . . . . 0.0 110.286 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 30' ' ' LYS . 3.0 ttpm? 33.45 -92.62 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.876 -0.515 . . . . 0.0 111.162 179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -49.04 91.7 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.883 -1.136 . . . . 0.0 110.601 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.535 ' CG ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -59.78 103.16 0.19 Allowed 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.255 -0.903 . . . . 0.0 111.4 -179.609 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 40.21 -163.63 0.01 OUTLIER Glycine 0 N--CA 1.491 2.342 0 N-CA-C 110.704 -0.958 . . . . 0.0 110.704 179.096 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.55 -169.02 0.2 Allowed 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.324 1.697 . . . . 0.0 111.214 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -87.24 4.53 42.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-O 123.161 1.457 . . . . 0.0 110.526 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.531 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.264 0.1 OUTLIER -70.13 160.7 31.57 Favored 'General case' 0 C--N 1.264 -3.142 0 CA-C-N 113.975 -1.466 . . . . 0.0 110.424 179.53 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.625 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.28 -22.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.645 -1.284 . . . . 0.0 112.63 179.725 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.0 -70.3 0.77 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.685 -1.26 . . . . 0.0 109.606 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -14.54 49.79 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.076 0.941 . . . . 0.0 108.647 178.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.18 -19.0 52.0 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.677 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.615 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.83 -56.44 6.28 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.112 -0.992 . . . . 0.0 109.704 179.675 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.612 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.2 mm? -63.41 -23.64 67.49 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.824 0.821 . . . . 0.0 109.885 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -56.78 -40.84 76.61 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.041 -1.037 . . . . 0.0 108.844 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.7 mmt-85 -89.84 -17.41 28.16 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.687 -0.633 . . . . 0.0 111.505 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.559 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 0.9 OUTLIER -39.47 -36.93 0.42 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.399 -0.813 . . . . 0.0 110.735 -179.297 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 2.7 mptt -76.09 13.8 0.82 Allowed 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.171 -0.956 . . . . 0.0 112.638 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -127.85 -72.86 0.17 Allowed Glycine 0 N--CA 1.49 2.268 0 C-N-CA 120.115 -1.041 . . . . 0.0 110.526 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.608 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.9 OUTLIER -75.71 39.56 0.17 Allowed 'General case' 0 C--N 1.289 -2.045 0 O-C-N 121.879 -0.777 . . . . 0.0 111.342 -178.94 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -98.68 -62.03 0.86 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -51.17 -43.73 28.11 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 CA-C-O 121.613 0.721 . . . . 0.0 110.51 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 2.8 ptpt -42.18 -59.8 1.67 Allowed 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.516 -0.74 . . . . 0.0 112.182 -178.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.658 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 3.9 p90 -90.12 -27.53 19.56 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.472 -1.392 . . . . 0.0 110.585 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.658 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -48.59 -52.78 21.19 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 120.777 -1.202 . . . . 0.0 109.21 179.483 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.509 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -60.11 -53.67 55.05 Favored 'General case' 0 C--N 1.285 -2.224 0 CA-C-O 122.467 1.127 . . . . 0.0 110.396 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -62.93 -52.58 62.51 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.722 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 40.8 mt -51.38 -24.67 5.03 Favored 'General case' 0 C--N 1.306 -1.319 0 O-C-N 120.787 -1.196 . . . . 0.0 110.833 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.509 ' HB ' ' O ' ' A' ' 52' ' ' ALA 0.329 0.3 OUTLIER -75.37 -56.73 7.87 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 CA-C-O 121.604 0.716 . . . . 0.0 109.832 179.537 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.471 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 122.2 46.55 0.3 Allowed Glycine 0 C--N 1.302 -1.332 0 N-CA-C 110.285 -1.126 . . . . 0.0 110.285 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.466 HG22 ' O ' ' A' ' 52' ' ' ALA 0.261 1.3 pt -76.73 -119.82 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.159 0 CA-C-O 122.571 1.177 . . . . 0.0 110.424 179.876 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.431 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 33.3 t70 . . . . . 0 C--N 1.26 -3.291 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.41 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 121.308 0.575 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -59.98 -11.08 4.94 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.366 -0.834 . . . . 0.0 110.654 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.48 145.6 14.64 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.109 -0.994 . . . . 0.0 110.426 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -45.65 -25.46 0.47 Allowed 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.304 -0.872 . . . . 0.0 110.688 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.499 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -55.41 -17.21 4.58 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.207 -0.933 . . . . 0.0 110.798 -179.552 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.499 ' C ' ' O ' ' A' ' 28' ' ' LYS . 0.5 OUTLIER 27.58 68.22 0.07 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 121.378 0.609 . . . . 0.0 111.41 179.554 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.464 ' O ' ' O ' ' A' ' 31' ' ' GLY . 7.7 mmtp -53.83 129.52 33.91 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.281 -0.887 . . . . 0.0 110.803 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 46.08 -175.29 0.01 OUTLIER Glycine 0 N--CA 1.487 2.042 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.507 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.5 Cg_endo -68.34 -166.05 0.14 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 124.249 1.657 . . . . 0.0 111.688 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.443 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.74 5.39 32.5 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 123.027 1.394 . . . . 0.0 110.879 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.587 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.261 0.0 OUTLIER -66.43 164.52 16.13 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 114.055 -1.43 . . . . 0.0 110.655 179.912 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.62 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 1.3 m -166.16 -22.12 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.938 -1.102 . . . . 0.0 112.733 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -103.22 -70.65 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.552 -1.343 . . . . 0.0 109.81 179.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.47 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 19.7 mt-10 -63.5 -15.11 56.92 Favored 'General case' 0 C--N 1.284 -2.276 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.62 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -77.73 -19.11 55.75 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.306 -179.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -44.33 -55.67 4.77 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.779 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.603 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.6 mm? -60.53 -26.67 67.05 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.85 0.833 . . . . 0.0 109.384 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.518 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -58.7 -41.03 85.35 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.05 -1.031 . . . . 0.0 108.224 178.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 44' ' ' LYS . 7.2 mmm-85 -89.73 -16.22 30.81 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.393 0.616 . . . . 0.0 110.82 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.572 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -42.04 -25.08 0.06 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.382 -0.824 . . . . 0.0 110.337 -179.644 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.611 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.6 mptp? -72.45 12.97 0.39 Allowed 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.217 -0.927 . . . . 0.0 112.871 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -89.65 -101.63 1.09 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 108.663 -1.775 . . . . 0.0 108.663 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.643 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -85.91 33.77 0.6 Allowed 'General case' 0 C--N 1.296 -1.721 0 O-C-N 121.554 -0.968 . . . . 0.0 109.938 179.394 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.483 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -97.72 -64.93 0.89 Allowed Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.416 ' O ' ' C ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -49.21 -43.42 16.2 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 CA-C-O 121.429 0.633 . . . . 0.0 110.477 179.877 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.527 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -42.11 -59.64 1.7 Allowed 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.446 -0.784 . . . . 0.0 111.676 -178.08 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.652 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 3.1 p90 -88.97 -26.47 21.48 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.43 -1.419 . . . . 0.0 110.489 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.652 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -53.97 -42.6 69.12 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 120.932 -1.105 . . . . 0.0 108.975 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.495 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -59.78 -54.28 48.11 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-O 122.431 1.11 . . . . 0.0 109.829 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -68.7 -53.06 24.45 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.534 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 30.3 mt -50.7 -22.5 2.11 Favored 'General case' 0 C--N 1.308 -1.196 0 O-C-N 120.751 -1.218 . . . . 0.0 110.399 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.541 ' CG2' HG21 ' A' ' 57' ' ' ILE 0.341 0.3 OUTLIER -75.5 -61.2 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 CA-C-O 121.644 0.735 . . . . 0.0 109.222 179.265 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.492 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 73.95 50.29 11.25 Favored Glycine 0 N--CA 1.483 1.806 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.181 177.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.541 HG21 ' CG2' ' A' ' 55' ' ' ILE 0.253 3.1 pt -72.43 -117.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.151 0 CA-C-O 122.597 1.189 . . . . 0.0 109.978 178.394 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.425 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 2.5 t70 . . . . . 0 C--N 1.26 -3.291 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.155 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.478 ' O ' ' N ' ' A' ' 26' ' ' LYS . 39.7 t . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.247 0.546 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' A' ' 26' ' ' LYS . 5.2 mtmp? -66.44 59.13 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.385 -0.822 . . . . 0.0 110.547 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.518 ' O ' ' N ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -54.6 -164.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.259 -0.901 . . . . 0.0 110.338 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.44 ' O ' ' C ' ' A' ' 28' ' ' LYS . 2.0 tt0 45.66 -91.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.341 -0.849 . . . . 0.0 110.154 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.546 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -41.29 119.4 1.2 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.282 -0.886 . . . . 0.0 109.865 179.768 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.546 ' C ' ' O ' ' A' ' 28' ' ' LYS . 4.9 ttmt -15.92 83.34 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 121.481 0.657 . . . . 0.0 111.938 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -51.07 130.09 25.23 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.396 -0.815 . . . . 0.0 110.945 -179.445 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.461 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 40.59 -162.77 0.01 OUTLIER Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.4 169.0 18.0 Favored 'Trans proline' 0 C--N 1.302 -1.884 0 O-C-N 124.187 1.625 . . . . 0.0 110.939 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.83 8.84 37.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 123.16 1.457 . . . . 0.0 110.235 -179.548 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.457 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.257 0.0 OUTLIER -62.01 157.64 18.27 Favored 'General case' 0 C--N 1.268 -2.958 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.26 179.532 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.613 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.1 -23.73 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.748 -1.22 . . . . 0.0 112.716 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t0 -101.5 -70.33 0.75 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.717 -1.239 . . . . 0.0 109.881 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.13 -14.74 52.17 Favored 'General case' 0 C--N 1.282 -2.348 0 CA-C-O 122.031 0.92 . . . . 0.0 108.572 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.613 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.85 -19.16 49.0 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.482 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -44.09 -56.2 4.2 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.616 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.5 mm? -64.91 -32.02 73.53 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.651 -0.656 . . . . 0.0 110.076 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.47 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -42.98 -33.1 0.74 Allowed 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.045 -1.034 . . . . 0.0 109.085 178.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -90.71 -17.35 26.91 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.346 0.594 . . . . 0.0 111.427 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.592 ' CD1' ' HA ' ' A' ' 40' ' ' LEU . 2.8 m-85 -55.49 -11.98 1.01 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.312 -0.868 . . . . 0.0 111.241 -179.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.596 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.8 mptt -70.53 13.54 0.17 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.049 -1.032 . . . . 0.0 113.207 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.41 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -59.84 -90.21 0.02 OUTLIER Glycine 0 N--CA 1.488 2.119 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.609 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 1.6 m-20 -85.67 30.02 0.67 Allowed 'General case' 0 C--N 1.293 -1.883 0 O-C-N 121.874 -0.78 . . . . 0.0 110.521 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.546 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -88.28 -54.53 2.4 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -49.48 -46.17 19.88 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.245 0 CA-C-O 121.373 0.606 . . . . 0.0 110.381 179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' CG ' ' O ' ' A' ' 46' ' ' ASP . 0.1 OUTLIER -44.48 -59.43 2.44 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.419 -0.8 . . . . 0.0 111.804 -178.128 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.656 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.0 p90 -90.22 -28.65 18.72 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 120.542 -1.349 . . . . 0.0 111.649 -179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.656 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 2.1 mmtm -53.44 -45.79 69.6 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 120.533 -1.354 . . . . 0.0 109.279 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.46 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -66.59 -55.07 17.07 Favored 'General case' 0 C--N 1.287 -2.141 0 CA-C-O 122.307 1.051 . . . . 0.0 109.841 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -56.45 -54.66 43.09 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.533 -179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 39.5 mt -51.49 -30.05 18.71 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 120.811 -1.181 . . . . 0.0 109.773 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.566 HG23 HG23 ' A' ' 57' ' ' ILE 0.344 0.3 OUTLIER -81.37 -62.84 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.993 179.848 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.513 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 72.31 50.02 18.19 Favored Glycine 0 N--CA 1.481 1.654 0 O-C-N 121.529 -0.732 . . . . 0.0 111.986 178.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.566 HG23 HG23 ' A' ' 55' ' ' ILE . 4.2 pt -72.38 -117.73 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 CA-C-O 122.661 1.219 . . . . 0.0 109.932 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.432 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 16.1 t0 . . . . . 0 C--N 1.26 -3.307 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.066 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.443 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 121.164 0.507 . . . . 0.0 110.135 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 24' ' ' SER . 5.7 tttp -177.09 93.42 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.289 -0.882 . . . . 0.0 110.354 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.442 ' O ' ' N ' ' A' ' 28' ' ' LYS . 2.7 tttt 54.47 67.47 1.01 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.478 -0.764 . . . . 0.0 110.558 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 26' ' ' LYS . 2.9 tt0 -42.0 -26.62 0.1 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.277 -0.889 . . . . 0.0 110.253 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 29' ' ' LYS . 6.6 tptt -56.79 -14.2 3.19 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.182 -0.949 . . . . 0.0 110.547 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -48.16 -177.98 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.368 -0.832 . . . . 0.0 110.613 -179.63 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.461 ' O ' ' O ' ' A' ' 31' ' ' GLY . 3.5 mttm -39.38 100.73 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.381 -0.824 . . . . 0.0 110.671 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.461 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 52.57 170.2 0.02 OUTLIER Glycine 0 N--CA 1.486 1.971 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -70.47 176.13 7.74 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 124.136 1.598 . . . . 0.0 110.928 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.45 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.6 8.91 31.83 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.214 1.483 . . . . 0.0 110.047 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.599 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.268 0.4 OUTLIER -70.66 -178.81 1.93 Allowed 'General case' 0 C--N 1.266 -3.022 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.772 179.784 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.625 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.63 -18.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.774 -1.204 . . . . 0.0 113.574 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' HA ' HD21 ' A' ' 39' ' ' LEU . 32.5 t70 -106.67 -70.97 0.77 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.384 -1.447 . . . . 0.0 110.506 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.471 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 6.4 mt-10 -63.25 -14.25 47.33 Favored 'General case' 0 C--N 1.283 -2.299 0 CA-C-O 122.25 1.024 . . . . 0.0 108.388 178.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' C ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.37 -18.51 52.24 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.405 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.35 -57.0 3.77 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.169 179.725 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.604 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.1 mm? -61.46 -37.49 83.77 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.554 -0.716 . . . . 0.0 109.508 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.448 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -47.41 -33.05 5.56 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.677 -1.265 . . . . 0.0 108.006 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.485 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -90.79 -20.19 22.63 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.916 -0.49 . . . . 0.0 111.347 179.79 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.604 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -43.18 -45.86 5.75 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.22 -0.925 . . . . 0.0 109.728 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.646 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 8.4 mptt -78.53 13.13 1.7 Allowed 'General case' 0 C--N 1.308 -1.237 0 O-C-N 121.333 -0.854 . . . . 0.0 111.83 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.507 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -74.2 -91.35 0.15 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -99.42 61.94 1.21 Allowed 'General case' 0 C--N 1.295 -1.767 0 O-C-N 121.695 -0.885 . . . . 0.0 109.705 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.49 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -139.8 -72.31 0.04 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.669 -1.773 . . . . 0.0 108.669 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.422 HG12 ' HA ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -62.9 -45.4 98.95 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.896 0 CA-C-O 121.386 0.612 . . . . 0.0 111.982 -179.664 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.2 OUTLIER -42.21 -60.29 1.51 Allowed 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.28 -0.887 . . . . 0.0 112.612 -177.078 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.679 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 10.5 p90 -82.93 -33.45 26.8 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.184 -1.573 . . . . 0.0 111.208 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.679 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -49.16 -56.63 8.6 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.683 -1.261 . . . . 0.0 109.252 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.466 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -50.18 -54.66 19.31 Favored 'General case' 0 C--N 1.284 -2.255 0 CA-C-O 122.336 1.065 . . . . 0.0 110.56 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -67.08 -53.66 28.79 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.496 -178.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 33.0 mt -51.15 -24.03 3.8 Favored 'General case' 0 C--N 1.307 -1.255 0 O-C-N 120.768 -1.208 . . . . 0.0 110.437 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.617 ' CG2' ' CG2' ' A' ' 57' ' ' ILE 0.336 0.3 OUTLIER -75.51 -58.72 4.12 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.783 0 CA-C-O 121.633 0.73 . . . . 0.0 109.512 179.627 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.468 ' N ' ' CG2' ' A' ' 55' ' ' ILE . . . 87.24 51.3 3.37 Favored Glycine 0 N--CA 1.48 1.614 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.806 178.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.617 ' CG2' ' CG2' ' A' ' 55' ' ' ILE 0.255 4.0 pt -73.75 -119.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.157 0 CA-C-O 122.743 1.259 . . . . 0.0 109.964 178.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.423 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 21.3 t0 . . . . . 0 C--N 1.261 -3.247 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.401 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.217 0.532 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.5 -24.95 0.95 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.307 -0.871 . . . . 0.0 110.377 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -47.08 -76.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.272 -0.893 . . . . 0.0 110.521 -179.868 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.455 ' HB3' ' O ' ' A' ' 26' ' ' LYS . 3.2 tp10 61.22 117.55 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.318 -0.864 . . . . 0.0 110.036 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -44.2 110.36 0.21 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.34 -0.85 . . . . 0.0 110.749 -179.835 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.62 78.3 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.406 -0.809 . . . . 0.0 110.556 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 28' ' ' LYS . 12.0 ptmm? -48.42 132.81 16.66 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.168 -0.957 . . . . 0.0 110.967 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.443 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -46.33 172.01 0.02 OUTLIER Glycine 0 N--CA 1.487 2.048 0 N-CA-C 109.9 -1.28 . . . . 0.0 109.9 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.21 149.55 64.2 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 O-C-N 123.984 1.518 . . . . 0.0 111.11 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -99.36 10.29 41.68 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 123.271 1.51 . . . . 0.0 109.843 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.574 ' CD ' ' HB2' ' A' ' 38' ' ' TYR 0.266 0.1 OUTLIER -81.64 91.25 6.39 Favored 'General case' 0 C--N 1.267 -3.017 0 CA-C-N 113.798 -1.546 . . . . 0.0 110.177 179.824 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.641 ' CA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -154.5 -30.72 0.11 Allowed 'General case' 0 C--N 1.291 -1.96 0 O-C-N 121.642 -0.661 . . . . 0.0 110.569 -179.792 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 2.9 t0 -107.19 -68.72 0.88 Allowed 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -13.39 59.91 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.641 ' CD1' ' CA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -80.33 -19.89 45.49 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.202 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.58 -56.53 5.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.166 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.597 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.1 mm? -60.78 -35.58 76.8 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.739 0.78 . . . . 0.0 109.839 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.422 ' C ' ' O ' ' A' ' 40' ' ' LEU . . . -46.85 -38.97 11.14 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 120.847 -1.158 . . . . 0.0 108.555 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -90.82 -17.46 26.55 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.715 -0.616 . . . . 0.0 111.722 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.597 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.3 m-85 -44.66 -40.01 5.53 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 110.977 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.6 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -68.76 14.55 0.07 Allowed 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.404 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -108.47 -103.35 2.84 Favored Glycine 0 C--N 1.288 -2.137 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.024 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.42 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -107.91 65.73 0.64 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.904 0.859 . . . . 0.0 109.956 -179.358 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.55 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -142.68 -75.84 0.04 OUTLIER Glycine 0 N--CA 1.485 1.905 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 179.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.519 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.3 OUTLIER -56.82 -46.59 83.47 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 CA-C-O 121.398 0.618 . . . . 0.0 111.283 179.834 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.547 ' HE3' ' N ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -41.85 -59.94 1.54 Allowed 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.36 -0.838 . . . . 0.0 112.032 -177.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.678 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.4 p90 -87.51 -27.83 22.4 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.261 -1.524 . . . . 0.0 111.362 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.678 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -52.2 -52.47 52.0 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.589 -1.32 . . . . 0.0 109.054 179.793 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.483 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -54.41 -54.01 46.37 Favored 'General case' 0 C--N 1.285 -2.237 0 CA-C-O 122.413 1.102 . . . . 0.0 110.422 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -66.1 -53.85 32.92 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.817 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 31.5 mt -51.15 -23.31 3.16 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 120.755 -1.216 . . . . 0.0 110.606 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.535 HG22 ' CG2' ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -75.76 -57.46 6.19 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.91 0 CA-C-O 121.604 0.716 . . . . 0.0 110.056 179.778 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.517 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 113.93 46.22 0.66 Allowed Glycine 0 C--N 1.301 -1.379 0 N-CA-C 110.081 -1.208 . . . . 0.0 110.081 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.535 ' CG2' HG22 ' A' ' 55' ' ' ILE 0.26 3.1 pt -76.3 -120.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.22 0 CA-C-O 122.648 1.213 . . . . 0.0 110.262 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 57' ' ' ILE . 26.2 t0 . . . . . 0 C--N 1.26 -3.288 0 CA-C-N 114.583 -1.19 . . . . 0.0 110.182 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.15 0.5 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 0.4 OUTLIER 174.84 176.16 0.17 Allowed 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.049 -1.032 . . . . 0.0 110.017 179.77 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 25' ' ' LYS . 38.9 tttt -178.12 42.6 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.3 -0.875 . . . . 0.0 110.024 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.493 ' O ' ' O ' ' A' ' 28' ' ' LYS . 21.4 pt-20 -45.17 -22.64 0.12 Allowed 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.272 -0.893 . . . . 0.0 110.58 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 27' ' ' GLU . 20.2 ptmt -53.09 -162.63 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.345 -0.847 . . . . 0.0 111.104 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 28' ' ' LYS . 2.2 ttpt -39.34 126.28 1.74 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.401 -0.812 . . . . 0.0 111.078 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' A' ' 31' ' ' GLY . 5.9 mttp -66.58 -174.44 0.3 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.313 -0.867 . . . . 0.0 110.364 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.463 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -54.11 -168.4 0.03 OUTLIER Glycine 0 N--CA 1.483 1.774 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.471 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.3 Cg_endo -67.47 -169.39 0.21 Allowed 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.108 1.583 . . . . 0.0 111.28 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -93.88 12.87 24.44 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 123.279 1.514 . . . . 0.0 110.088 -179.557 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.538 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.26 0.1 OUTLIER -60.67 157.19 15.1 Favored 'General case' 0 C--N 1.265 -3.07 0 CA-C-N 113.957 -1.474 . . . . 0.0 110.641 179.473 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.604 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -165.5 -27.04 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.928 -1.108 . . . . 0.0 111.797 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.4 OUTLIER -97.33 -70.85 0.7 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.915 -1.115 . . . . 0.0 109.774 179.488 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -63.55 -14.65 53.32 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 122.005 0.907 . . . . 0.0 108.667 178.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.604 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.58 -19.79 51.99 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.266 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -45.62 -56.04 5.65 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.214 -0.929 . . . . 0.0 108.994 178.619 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.617 ' N ' ' CD2' ' A' ' 40' ' ' LEU . 2.4 mm? -62.37 -24.83 67.58 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 121.844 0.831 . . . . 0.0 109.758 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.51 ' CB ' ' O ' ' A' ' 38' ' ' TYR . . . -55.22 -44.76 75.73 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.085 -1.009 . . . . 0.0 108.567 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.433 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.1 OUTLIER -89.49 -17.78 27.99 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.382 0.61 . . . . 0.0 110.998 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.597 ' CG ' ' HA ' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -41.05 -44.31 2.39 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.419 -0.8 . . . . 0.0 110.335 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.619 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 12.0 mptt -73.0 14.37 0.29 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.043 -1.036 . . . . 0.0 113.151 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.472 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -156.46 -99.24 0.16 Allowed Glycine 0 N--CA 1.489 2.225 0 C-N-CA 119.491 -1.337 . . . . 0.0 111.702 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.505 ' HA ' ' CD ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -92.45 58.85 3.27 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.677 -0.896 . . . . 0.0 110.252 -178.575 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.525 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -130.73 -67.35 0.1 OUTLIER Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.202 -1.959 . . . . 0.0 108.202 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.524 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.2 OUTLIER -67.36 -44.19 87.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.505 ' CD ' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -41.51 -58.8 1.79 Allowed 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.269 -0.894 . . . . 0.0 113.214 -176.74 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.673 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 18.3 p90 -89.3 -37.8 14.66 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.291 -1.505 . . . . 0.0 112.327 -178.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.673 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -49.17 -53.53 20.7 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 120.225 -1.547 . . . . 0.0 109.82 -179.831 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.469 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -59.15 -54.08 51.08 Favored 'General case' 0 C--N 1.283 -2.285 0 CA-C-O 122.463 1.125 . . . . 0.0 110.315 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.52 -53.34 56.18 Favored 'General case' 0 C--N 1.284 -2.273 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.397 -178.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 40.1 mt -51.46 -26.58 8.41 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 120.823 -1.173 . . . . 0.0 110.795 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.522 HG23 ' CG2' ' A' ' 57' ' ' ILE 0.334 0.3 OUTLIER -74.93 -54.88 13.34 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 CA-C-O 121.82 0.819 . . . . 0.0 109.958 179.81 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.512 ' N ' HG23 ' A' ' 55' ' ' ILE . . . 111.51 48.97 0.67 Allowed Glycine 0 C--N 1.299 -1.491 0 N-CA-C 110.048 -1.221 . . . . 0.0 110.048 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.522 ' CG2' HG23 ' A' ' 55' ' ' ILE 0.266 2.7 pt -76.5 -121.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.168 0 CA-C-O 122.768 1.271 . . . . 0.0 109.899 179.7 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.43 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 4.2 p-10 . . . . . 0 C--N 1.261 -3.274 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.501 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo . . . . . 0 N--CA 1.484 0.915 0 CA-C-O 121.187 0.411 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.451 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.95 14.67 31.31 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-O 123.021 1.391 . . . . 0.0 110.171 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.577 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.258 0.1 OUTLIER -56.35 159.9 3.35 Favored 'General case' 0 C--N 1.267 -2.993 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.66 179.75 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.698 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -163.5 -19.74 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.954 -1.091 . . . . 0.0 113.142 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -103.09 -70.42 0.76 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.43 -1.419 . . . . 0.0 110.024 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.01 -13.77 60.48 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.18 0.99 . . . . 0.0 108.506 178.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.791 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.9 -20.01 53.67 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.236 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.679 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.54 -55.82 5.81 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.197 -0.939 . . . . 0.0 108.762 178.904 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.878 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.8 mm? -58.77 -25.89 63.49 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 121.679 0.752 . . . . 0.0 109.489 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.791 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -62.99 -50.57 70.21 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -86.89 -14.53 41.68 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.629 -0.67 . . . . 0.0 110.464 179.688 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.878 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.6 OUTLIER -40.32 -42.36 1.53 Allowed 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 121.38 0.609 . . . . 0.0 110.239 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -75.76 13.63 0.79 Allowed 'General case' 0 C--N 1.307 -1.28 0 O-C-N 121.322 -0.861 . . . . 0.0 112.77 -178.839 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -131.64 -104.99 1.0 Allowed Glycine 0 C--N 1.288 -2.111 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -91.29 33.04 0.99 Allowed 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.67 -0.9 . . . . 0.0 110.991 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -84.4 -48.55 5.0 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 108.398 -1.881 . . . . 0.0 108.398 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.283 -2.325 0 CA-C-N 114.521 -0.84 . . . . 0.0 111.012 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 N--CA 1.483 0.888 0 CA-C-O 121.313 0.464 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -96.28 13.87 26.11 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 123.14 1.447 . . . . 0.0 109.833 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.557 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.255 4.5 mmtp -70.54 157.0 38.67 Favored 'General case' 0 C--N 1.267 -2.978 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.785 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.622 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -167.19 -27.08 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 O-C-N 121.086 -1.009 . . . . 0.0 111.779 179.595 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.519 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.7 t70 -101.64 -69.96 0.76 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.04 -1.037 . . . . 0.0 109.522 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.547 ' CB ' ' HE2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -61.35 -16.13 43.1 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-O 122.077 0.942 . . . . 0.0 108.568 178.234 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.734 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -78.47 -18.98 54.08 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.298 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.597 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.39 -57.12 4.29 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.271 -0.893 . . . . 0.0 109.545 179.284 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.786 HD13 ' CG ' ' A' ' 43' ' ' PHE . 2.2 mm? -61.53 -32.75 72.82 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.549 -0.719 . . . . 0.0 109.717 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.734 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -44.36 -32.47 1.34 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 120.934 -1.104 . . . . 0.0 108.67 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -91.22 -16.91 26.89 Favored 'General case' 0 C--N 1.309 -1.192 0 O-C-N 121.729 -0.607 . . . . 0.0 111.649 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.786 ' CG ' HD13 ' A' ' 40' ' ' LEU . 1.4 m-85 -48.68 -17.61 0.19 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.291 -0.881 . . . . 0.0 111.41 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.8 OUTLIER -68.58 13.45 0.1 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.941 -1.099 . . . . 0.0 113.269 -178.608 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -89.32 -93.72 1.12 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.432 ' OD1' ' N ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -99.46 60.59 1.15 Allowed 'General case' 0 C--N 1.297 -1.691 0 O-C-N 121.709 -0.877 . . . . 0.0 109.541 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -141.57 -77.48 0.05 OUTLIER Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.136 -1.586 . . . . 0.0 109.136 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.427 ' CG1' ' HA ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.296 -1.745 0 O-C-N 122.103 -0.645 . . . . 0.0 110.903 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.516 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 41.2 Cg_endo . . . . . 0 N--CA 1.483 0.9 0 CA-C-O 121.343 0.476 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.16 10.69 23.51 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.886 1.326 . . . . 0.0 110.537 -179.271 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 38' ' ' TYR 0.258 0.0 OUTLIER -63.33 114.79 4.04 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.035 179.552 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.679 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -140.44 -13.84 1.0 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 118.931 -1.107 . . . . 0.0 112.418 -179.414 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.463 ' HA ' HD23 ' A' ' 39' ' ' LEU . 63.8 t0 -107.1 -70.32 0.8 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.153 -0.967 . . . . 0.0 109.785 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -63.2 -15.78 58.05 Favored 'General case' 0 C--N 1.283 -2.319 0 CA-C-O 122.207 1.004 . . . . 0.0 108.466 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.679 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.97 -18.61 49.9 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.673 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.23 -56.99 4.96 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.156 -0.965 . . . . 0.0 109.588 179.636 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.895 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -61.16 -35.93 78.46 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.471 -0.768 . . . . 0.0 109.59 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.675 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -46.25 -35.36 5.16 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.952 -1.093 . . . . 0.0 108.5 178.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -90.82 -18.34 25.05 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.804 -0.56 . . . . 0.0 111.44 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.895 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.2 m-85 -45.73 -26.62 0.67 Allowed 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.164 -0.96 . . . . 0.0 110.235 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.628 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.6 mptp? -75.67 13.37 0.82 Allowed 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.351 -0.843 . . . . 0.0 112.559 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.3 -95.09 0.83 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.11 59.62 2.28 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.751 -0.853 . . . . 0.0 109.56 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -139.31 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.485 1.959 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.428 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.801 0 CA-C-O 121.456 0.646 . . . . 0.0 111.328 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo . . . . . 0 N--CA 1.481 0.788 0 CA-C-O 121.313 0.464 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.488 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -95.38 17.0 15.36 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 123.198 1.475 . . . . 0.0 109.473 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.575 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.259 0.1 OUTLIER -50.94 151.62 2.48 Favored 'General case' 0 C--N 1.269 -2.902 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.02 179.966 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.626 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -157.45 -27.0 0.09 Allowed 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.207 -0.933 . . . . 0.0 111.975 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -98.58 -69.79 0.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.921 -1.112 . . . . 0.0 109.579 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HA ' ' OE1' ' A' ' 37' ' ' GLU . 1.9 mm-40 -61.88 -15.04 39.4 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 121.965 0.888 . . . . 0.0 109.056 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.731 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -80.68 -19.28 45.52 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.876 -179.51 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.671 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.9 -56.46 5.41 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 120.99 -1.069 . . . . 0.0 109.343 178.742 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.773 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -60.33 -34.75 74.27 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.69 0.757 . . . . 0.0 109.734 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.731 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.61 -35.64 1.83 Allowed 'General case' 0 C--N 1.3 -1.551 0 O-C-N 120.902 -1.124 . . . . 0.0 108.746 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -90.76 -19.1 23.88 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.712 -0.617 . . . . 0.0 111.417 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.773 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -46.46 -38.61 9.38 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.206 -0.934 . . . . 0.0 110.32 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.0 OUTLIER -75.19 13.2 0.75 Allowed 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.345 -0.847 . . . . 0.0 112.796 -178.47 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.46 -94.69 0.1 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.21 38.33 0.17 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.628 -0.924 . . . . 0.0 111.419 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -88.46 -50.32 3.42 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 108.142 -1.983 . . . . 0.0 108.142 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.287 -2.138 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.079 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo . . . . . 0 N--CA 1.48 0.735 0 N-CA-C 110.756 -0.517 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.544 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.46 2.08 53.52 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 123.145 1.45 . . . . 0.0 110.166 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.513 ' HD3' ' HB3' ' A' ' 38' ' ' TYR 0.251 1.3 mmtp -67.91 153.77 43.0 Favored 'General case' 0 C--N 1.264 -3.139 0 CA-C-N 113.997 -1.456 . . . . 0.0 110.046 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.679 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.09 -24.67 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.05 -1.031 . . . . 0.0 112.236 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -70.75 0.71 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.916 -1.115 . . . . 0.0 110.014 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.73 -13.35 54.44 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-O 122.002 0.906 . . . . 0.0 108.765 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.791 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.57 -19.58 49.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.428 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -47.47 -56.64 6.61 Favored 'General case' 0 C--N 1.306 -1.283 0 O-C-N 121.065 -1.022 . . . . 0.0 109.152 178.893 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.612 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 1.8 mm? -58.64 -34.15 70.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.856 0.836 . . . . 0.0 109.219 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.791 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.22 -35.87 8.13 Favored 'General case' 0 C--N 1.297 -1.716 0 O-C-N 120.928 -1.108 . . . . 0.0 108.049 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.462 ' HD3' ' OD1' ' A' ' 46' ' ' ASP . 3.4 mtt180 -90.5 -20.61 22.49 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 121.809 -0.557 . . . . 0.0 111.452 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.612 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.1 m-85 -42.66 -34.83 0.96 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.205 -0.934 . . . . 0.0 109.965 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.5 mptt -77.81 13.29 1.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.416 -0.803 . . . . 0.0 112.224 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -151.54 -96.01 0.13 Allowed Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.462 ' OD1' ' HD3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -84.35 55.78 3.5 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.716 -0.873 . . . . 0.0 109.284 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.417 ' HA3' ' HA ' ' A' ' 43' ' ' PHE . . . -129.88 -77.82 0.19 Allowed Glycine 0 N--CA 1.487 2.099 0 N-CA-C 108.379 -1.889 . . . . 0.0 108.379 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.458 HG12 ' H ' ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.294 -1.825 0 O-C-N 122.003 -0.704 . . . . 0.0 110.499 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.548 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.2 Cg_endo . . . . . 0 N--CA 1.483 0.88 0 CA-C-O 121.409 0.504 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.446 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.6 9.34 16.36 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.908 1.337 . . . . 0.0 111.039 -178.827 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.563 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.262 0.0 OUTLIER -60.72 161.22 8.17 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.22 179.352 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.658 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -163.79 -26.66 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.724 -1.235 . . . . 0.0 112.402 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -97.17 -70.55 0.71 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.794 -1.191 . . . . 0.0 110.104 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.1 -13.78 50.13 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.968 0.889 . . . . 0.0 109.022 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.781 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.88 -19.52 48.06 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.186 -179.434 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.734 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -49.31 -55.69 11.98 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 120.804 -1.185 . . . . 0.0 108.793 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.663 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -59.19 -25.76 64.23 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.932 0.872 . . . . 0.0 109.341 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.781 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -54.3 -37.58 64.95 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 120.957 -1.09 . . . . 0.0 108.197 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' LYS . 18.3 mmm180 -90.23 -18.33 25.88 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.412 0.625 . . . . 0.0 111.187 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.663 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.1 m-85 -43.33 -23.12 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.311 -0.868 . . . . 0.0 110.799 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.53 12.81 0.56 Allowed 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.108 -0.995 . . . . 0.0 112.441 -178.994 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -74.0 -84.16 0.31 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 110.089 -1.204 . . . . 0.0 110.089 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.25 59.39 2.61 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.617 0.722 . . . . 0.0 109.484 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -139.83 -76.98 0.05 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.438 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.768 0 O-C-N 122.094 -0.65 . . . . 0.0 110.702 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo . . . . . 0 N--CA 1.482 0.841 0 N-CA-C 110.734 -0.525 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.533 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -91.18 7.3 41.36 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 123.234 1.492 . . . . 0.0 110.271 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.546 ' NZ ' ' HB2' ' A' ' 37' ' ' GLU 0.259 0.3 OUTLIER -73.44 138.08 44.96 Favored 'General case' 0 C--N 1.263 -3.166 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.446 179.742 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.625 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -170.76 -25.99 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.257 -0.902 . . . . 0.0 111.403 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -102.79 -69.74 0.78 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.139 -0.976 . . . . 0.0 109.059 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.546 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 4.7 mt-10 -63.13 -15.1 55.66 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.73 -19.52 52.16 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.326 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.585 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -45.64 -56.35 5.3 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.121 -0.987 . . . . 0.0 109.541 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.823 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -62.73 -37.94 88.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.58 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.81 -39.28 8.18 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.823 -1.173 . . . . 0.0 108.792 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.446 ' HD3' ' HB2' ' A' ' 46' ' ' ASP . 8.0 mtt180 -91.0 -17.21 26.66 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.714 -0.616 . . . . 0.0 111.767 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.823 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.5 m-85 -44.16 -42.28 6.3 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.217 -0.927 . . . . 0.0 110.96 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -73.34 12.93 0.5 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.191 -0.943 . . . . 0.0 112.966 -178.58 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -160.27 -96.66 0.11 Allowed Glycine 0 C--N 1.286 -2.217 0 C-N-CA 120.013 -1.089 . . . . 0.0 110.404 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.446 ' HB2' ' HD3' ' A' ' 42' ' ' ARG . 5.9 m-20 -75.55 36.44 0.13 Allowed 'General case' 0 C--N 1.296 -1.735 0 O-C-N 121.617 -0.931 . . . . 0.0 112.011 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -88.57 -50.12 3.45 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.415 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.285 -2.214 0 CA-C-N 114.763 -0.718 . . . . 0.0 110.884 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 N--CA 1.481 0.77 0 N-CA-C 110.848 -0.482 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.97 12.63 33.56 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 123.155 1.455 . . . . 0.0 109.848 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.565 ' CD ' ' HB3' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -61.49 158.39 14.99 Favored 'General case' 0 C--N 1.267 -3.0 0 CA-C-N 113.925 -1.489 . . . . 0.0 110.52 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.626 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.53 -24.92 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 O-C-N 121.028 -1.045 . . . . 0.0 112.395 179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.454 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 m-20 -100.2 -70.41 0.74 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.814 -1.179 . . . . 0.0 109.873 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -62.83 -15.1 52.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-O 122.071 0.938 . . . . 0.0 108.663 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.626 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.93 -19.27 52.21 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.348 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.589 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.06 -56.96 4.2 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.211 -0.931 . . . . 0.0 109.48 178.95 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.924 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -62.51 -37.99 88.19 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.614 0.721 . . . . 0.0 109.869 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.34 -37.12 10.44 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.718 -1.239 . . . . 0.0 108.461 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -19.25 23.94 Favored 'General case' 0 C--N 1.308 -1.196 0 O-C-N 121.739 -0.601 . . . . 0.0 111.5 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.924 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.5 m-30 -43.92 -44.05 6.85 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.253 -0.904 . . . . 0.0 110.436 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.658 ' HB3' HG11 ' A' ' 48' ' ' VAL . 1.6 mptm? -74.42 13.32 0.61 Allowed 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.251 -0.906 . . . . 0.0 112.321 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.66 -82.03 0.05 OUTLIER Glycine 0 N--CA 1.489 2.218 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.77 65.04 0.99 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-O 121.848 0.832 . . . . 0.0 109.97 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -145.12 -69.35 0.02 OUTLIER Glycine 0 N--CA 1.486 2.031 0 N-CA-C 108.389 -1.885 . . . . 0.0 108.389 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.658 HG11 ' HB3' ' A' ' 44' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.291 -1.949 0 O-C-N 122.344 -0.504 . . . . 0.0 111.864 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.422 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 41.3 Cg_endo . . . . . 0 N--CA 1.482 0.809 0 N-CA-C 110.739 -0.523 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.448 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.88 13.79 19.41 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 123.141 1.448 . . . . 0.0 109.841 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.576 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -64.12 153.29 38.12 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.702 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.703 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -159.64 -29.18 0.07 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.154 -0.966 . . . . 0.0 111.705 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.488 ' HA ' HD22 ' A' ' 39' ' ' LEU . 1.5 t0 -93.43 -69.82 0.73 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.161 -0.962 . . . . 0.0 109.829 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.434 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 0.8 OUTLIER -64.19 -13.64 49.98 Favored 'General case' 0 C--N 1.287 -2.144 0 CA-C-O 121.902 0.858 . . . . 0.0 109.152 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.795 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -82.84 -17.83 42.54 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 121.308 0.575 . . . . 0.0 110.076 -179.816 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.604 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -47.72 -55.59 9.2 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.212 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.806 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -58.67 -33.55 70.25 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-O 121.963 0.887 . . . . 0.0 109.095 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.795 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -48.67 -43.05 36.5 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.978 -1.076 . . . . 0.0 108.299 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 44' ' ' LYS . 2.1 mmp_? -90.61 -16.58 28.42 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.733 -0.604 . . . . 0.0 111.591 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.806 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -42.35 -24.48 0.05 Allowed 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 110.793 -179.051 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -70.93 12.87 0.23 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.092 -1.005 . . . . 0.0 112.897 -178.882 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -126.28 -104.09 1.37 Allowed Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 46' ' ' ASP . 1.5 m-20 -82.15 35.63 0.44 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.374 -1.074 . . . . 0.0 110.819 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -89.82 -51.84 2.75 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 108.552 -1.819 . . . . 0.0 108.552 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.455 HG12 ' H ' ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.288 -2.081 0 CA-C-N 114.948 -0.626 . . . . 0.0 110.536 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.0 Cg_endo . . . . . 0 N--CA 1.485 0.983 0 CA-C-O 121.514 0.547 . . . . 0.0 111.602 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -79.32 2.38 21.69 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.909 1.338 . . . . 0.0 111.503 -178.796 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.55 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.251 0.1 OUTLIER -66.15 149.28 50.55 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.762 178.968 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.762 ' O ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -166.25 -24.87 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.993 -1.067 . . . . 0.0 112.226 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -97.2 -70.08 0.73 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.97 -1.081 . . . . 0.0 109.722 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -13.12 57.11 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 121.914 0.864 . . . . 0.0 109.031 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.702 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -81.2 -19.11 43.98 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.113 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 35' ' ' THR . 0.2 OUTLIER -50.31 -56.64 10.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.009 -1.057 . . . . 0.0 109.406 179.321 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.812 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -63.33 -32.25 73.61 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.42 -37.45 5.11 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.877 -1.139 . . . . 0.0 108.883 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.29 -18.58 25.35 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.645 -0.659 . . . . 0.0 111.5 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.812 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -44.29 -33.79 1.72 Allowed 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.093 -1.004 . . . . 0.0 110.101 -179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.617 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 9.6 mptt -77.51 12.18 1.7 Allowed 'General case' 0 C--N 1.308 -1.201 0 O-C-N 121.163 -0.96 . . . . 0.0 112.079 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -115.05 -100.72 2.32 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.24 33.13 0.39 Allowed 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.509 -0.995 . . . . 0.0 110.473 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.46 -51.89 3.17 Favored Glycine 0 N--CA 1.485 1.933 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.462 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.286 -2.193 0 CA-C-N 114.972 -0.614 . . . . 0.0 110.288 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo . . . . . 0 N--CA 1.483 0.865 0 CA-C-O 121.327 0.47 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.49 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.9 9.93 28.44 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 123.038 1.399 . . . . 0.0 110.242 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.553 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -60.75 151.51 29.31 Favored 'General case' 0 C--N 1.267 -2.983 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.844 179.298 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.698 ' O ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -166.49 -23.15 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.987 -1.07 . . . . 0.0 112.563 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -99.59 -70.07 0.74 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.76 -1.212 . . . . 0.0 109.868 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.89 -13.95 58.17 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-O 121.992 0.901 . . . . 0.0 108.774 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.691 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.5 -19.45 49.66 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.719 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.698 HD22 ' O ' ' A' ' 35' ' ' THR . 0.2 OUTLIER -48.92 -56.99 7.18 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.173 -0.954 . . . . 0.0 109.364 179.429 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.714 HD13 ' CG ' ' A' ' 43' ' ' PHE . 2.5 mm? -61.8 -32.35 72.64 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.666 0.746 . . . . 0.0 110.001 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.55 -36.92 4.95 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 120.943 -1.098 . . . . 0.0 108.814 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.3 OUTLIER -90.53 -19.83 23.34 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.627 -0.671 . . . . 0.0 111.644 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.714 ' CG ' HD13 ' A' ' 40' ' ' LEU . 1.2 m-85 -41.98 -41.8 2.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.214 -0.929 . . . . 0.0 110.45 -179.051 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.616 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.87 12.98 0.57 Allowed 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.019 -1.051 . . . . 0.0 112.364 -179.32 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -87.42 -99.81 0.87 Allowed Glycine 0 C--N 1.288 -2.096 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -81.14 38.69 0.48 Allowed 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.529 -0.983 . . . . 0.0 110.817 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -100.51 -63.07 0.79 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.424 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.287 -2.124 0 CA-C-O 121.561 0.696 . . . . 0.0 110.395 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo . . . . . 0 N--CA 1.484 0.939 0 CA-C-O 121.322 0.467 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.92 7.46 34.37 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 123.01 1.386 . . . . 0.0 110.368 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.531 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.256 0.2 OUTLIER -69.7 159.97 32.52 Favored 'General case' 0 C--N 1.266 -3.062 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.191 179.641 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.704 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -167.88 -28.64 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 O-C-N 120.922 -1.111 . . . . 0.0 111.803 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 8.9 t70 -94.78 -70.25 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.063 -1.023 . . . . 0.0 109.97 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -63.52 -14.47 51.44 Favored 'General case' 0 C--N 1.283 -2.301 0 CA-C-O 122.041 0.924 . . . . 0.0 109.091 178.719 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.704 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -82.04 -18.15 44.24 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.088 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -46.16 -57.11 4.8 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.353 -0.842 . . . . 0.0 109.46 179.074 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.641 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -61.13 -37.93 84.57 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.565 -0.709 . . . . 0.0 109.876 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.72 -35.48 1.85 Allowed 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.053 -1.029 . . . . 0.0 108.746 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 43' ' ' PHE . 24.7 mtp180 -91.71 -17.62 25.18 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 121.822 -0.549 . . . . 0.0 112.079 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.659 ' O ' HG12 ' A' ' 48' ' ' VAL . 0.8 OUTLIER -40.12 -61.67 0.85 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.156 -0.965 . . . . 0.0 111.027 -178.465 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.1 mptm? -77.48 13.77 1.15 Allowed 'General case' 0 C--N 1.309 -1.168 0 O-C-N 121.143 -0.973 . . . . 0.0 112.498 -179.125 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.94 -100.54 1.34 Allowed Glycine 0 C--N 1.287 -2.167 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.434 ' OD1' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -106.9 62.71 0.63 Allowed 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.794 -0.827 . . . . 0.0 109.733 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -145.58 -83.02 0.05 OUTLIER Glycine 0 N--CA 1.485 1.937 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.659 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.298 -1.659 0 O-C-N 121.985 -0.714 . . . . 0.0 110.848 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo . . . . . 0 N--CA 1.483 0.893 0 N-CA-C 110.859 -0.477 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.441 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -94.03 6.88 47.11 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 122.918 1.342 . . . . 0.0 110.532 -179.562 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.557 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.252 0.0 OUTLIER -75.96 142.89 41.86 Favored 'General case' 0 C--N 1.264 -3.149 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.588 179.918 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.618 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -169.05 -25.32 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.267 -0.896 . . . . 0.0 111.618 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.05 -70.38 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.98 -1.075 . . . . 0.0 109.419 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.428 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -65.47 -13.56 59.06 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.038 0.923 . . . . 0.0 108.545 178.118 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.633 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.12 -19.9 56.36 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.131 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -50.87 -56.53 11.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.28 -0.887 . . . . 0.0 109.357 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.762 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -61.73 -35.17 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.116 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.14 -36.9 1.84 Allowed 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.054 -1.029 . . . . 0.0 109.009 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.4 mtp180 -90.69 -19.57 23.45 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.627 -0.67 . . . . 0.0 111.806 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.762 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -42.24 -48.88 5.0 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.142 -0.974 . . . . 0.0 110.627 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.2 mptp? -73.62 13.42 0.48 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.17 -0.957 . . . . 0.0 112.822 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.89 -12.77 48.87 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.462 ' OD2' ' O ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -86.4 49.15 1.74 Allowed 'General case' 0 C--N 1.287 -2.122 0 O-C-N 121.766 -0.844 . . . . 0.0 110.116 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -112.8 -73.8 0.65 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.498 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.938 0 CA-C-O 121.628 0.727 . . . . 0.0 110.625 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo . . . . . 0 N--CA 1.483 0.891 0 N-CA-C 110.927 -0.451 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.543 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -98.81 7.52 45.97 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 123.166 1.46 . . . . 0.0 110.201 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.568 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 1.7 mmtp -69.37 153.6 43.33 Favored 'General case' 0 C--N 1.265 -3.086 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.596 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.668 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -165.66 -24.65 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.139 -0.976 . . . . 0.0 112.113 179.719 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 23.3 t0 -101.37 -69.76 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.717 -1.239 . . . . 0.0 109.276 179.161 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.2 -14.88 54.13 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 178.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.698 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.17 -19.54 50.68 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.654 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.69 -56.41 4.45 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.158 -0.964 . . . . 0.0 109.424 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.778 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.6 mm? -59.33 -32.39 70.05 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.848 0.832 . . . . 0.0 109.456 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.698 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -57.61 -41.48 81.37 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.497 ' O ' ' N ' ' A' ' 44' ' ' LYS . 16.3 mmt180 -90.18 -16.7 28.96 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.435 0.636 . . . . 0.0 111.205 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.778 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -39.77 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.474 -0.766 . . . . 0.0 111.318 -179.033 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.597 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.7 OUTLIER -74.1 12.83 0.64 Allowed 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.85 -1.156 . . . . 0.0 112.378 -179.198 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 47' ' ' GLY . . . -42.65 -69.87 0.56 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.5 59.87 0.06 Allowed 'General case' 0 C--N 1.288 -2.085 0 CA-C-O 121.86 0.838 . . . . 0.0 109.422 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 45' ' ' GLY . . . -140.23 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.316 -1.514 . . . . 0.0 109.316 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.475 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.771 0 O-C-N 121.943 -0.74 . . . . 0.0 111.592 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo . . . . . 0 N--CA 1.484 0.918 0 CA-C-O 121.264 0.443 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.51 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -87.24 4.53 42.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-O 123.161 1.457 . . . . 0.0 110.526 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.264 0.1 OUTLIER -70.13 160.7 31.57 Favored 'General case' 0 C--N 1.264 -3.142 0 CA-C-N 113.975 -1.466 . . . . 0.0 110.424 179.53 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.634 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.28 -22.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.645 -1.284 . . . . 0.0 112.63 179.725 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.0 -70.3 0.77 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.685 -1.26 . . . . 0.0 109.606 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -14.54 49.79 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.076 0.941 . . . . 0.0 108.647 178.138 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.736 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.18 -19.0 52.0 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.677 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.615 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.83 -56.44 6.28 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.112 -0.992 . . . . 0.0 109.704 179.675 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.77 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -63.41 -23.64 67.49 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.824 0.821 . . . . 0.0 109.885 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.736 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -56.78 -40.84 76.61 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.041 -1.037 . . . . 0.0 108.844 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.7 mmt-85 -89.84 -17.41 28.16 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.687 -0.633 . . . . 0.0 111.505 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.77 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -39.47 -36.93 0.42 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.399 -0.813 . . . . 0.0 110.735 -179.297 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 2.7 mptt -76.09 13.8 0.82 Allowed 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.171 -0.956 . . . . 0.0 112.638 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -127.85 -72.86 0.17 Allowed Glycine 0 N--CA 1.49 2.268 0 C-N-CA 120.115 -1.041 . . . . 0.0 110.526 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -75.71 39.56 0.17 Allowed 'General case' 0 C--N 1.289 -2.045 0 O-C-N 121.879 -0.777 . . . . 0.0 111.342 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -98.68 -62.03 0.86 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.453 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.29 -1.988 0 CA-C-O 121.613 0.721 . . . . 0.0 110.51 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.5 Cg_endo . . . . . 0 N--CA 1.486 1.048 0 CA-C-O 121.593 0.58 . . . . 0.0 111.688 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.443 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.74 5.39 32.5 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 123.027 1.394 . . . . 0.0 110.879 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.619 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.261 0.0 OUTLIER -66.43 164.52 16.13 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 114.055 -1.43 . . . . 0.0 110.655 179.912 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.656 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 1.3 m -166.16 -22.12 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.938 -1.102 . . . . 0.0 112.733 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -103.22 -70.65 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.552 -1.343 . . . . 0.0 109.81 179.443 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.472 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 19.7 mt-10 -63.5 -15.11 56.92 Favored 'General case' 0 C--N 1.284 -2.276 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.776 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.73 -19.11 55.75 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.306 -179.944 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.591 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -44.33 -55.67 4.77 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.779 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.826 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.6 mm? -60.53 -26.67 67.05 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.85 0.833 . . . . 0.0 109.384 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -58.7 -41.03 85.35 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.05 -1.031 . . . . 0.0 108.224 178.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 44' ' ' LYS . 7.2 mmm-85 -89.73 -16.22 30.81 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.393 0.616 . . . . 0.0 110.82 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.826 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -42.04 -25.08 0.06 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.382 -0.824 . . . . 0.0 110.337 -179.644 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.611 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.6 mptp? -72.45 12.97 0.39 Allowed 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.217 -0.927 . . . . 0.0 112.871 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -89.65 -101.63 1.09 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 108.663 -1.775 . . . . 0.0 108.663 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 46' ' ' ASP . 0.4 OUTLIER -85.91 33.77 0.6 Allowed 'General case' 0 C--N 1.296 -1.721 0 O-C-N 121.554 -0.968 . . . . 0.0 109.938 179.394 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -97.72 -64.93 0.89 Allowed Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.448 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.289 -2.036 0 CA-C-O 121.429 0.633 . . . . 0.0 110.477 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo . . . . . 0 N--CA 1.483 0.881 0 N-CA-C 110.939 -0.447 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.83 8.84 37.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 123.16 1.457 . . . . 0.0 110.235 -179.548 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.478 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.257 0.0 OUTLIER -62.01 157.64 18.27 Favored 'General case' 0 C--N 1.268 -2.958 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.26 179.532 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.666 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.1 -23.73 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.748 -1.22 . . . . 0.0 112.716 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t0 -101.5 -70.33 0.75 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.717 -1.239 . . . . 0.0 109.881 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.13 -14.74 52.17 Favored 'General case' 0 C--N 1.282 -2.348 0 CA-C-O 122.031 0.92 . . . . 0.0 108.572 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.691 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.85 -19.16 49.0 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.482 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -44.09 -56.2 4.2 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.881 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.5 mm? -64.91 -32.02 73.53 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.651 -0.656 . . . . 0.0 110.076 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -42.98 -33.1 0.74 Allowed 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.045 -1.034 . . . . 0.0 109.085 178.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -90.71 -17.35 26.91 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.346 0.594 . . . . 0.0 111.427 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.881 ' CD2' HD13 ' A' ' 40' ' ' LEU . 2.8 m-85 -55.49 -11.98 1.01 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.312 -0.868 . . . . 0.0 111.241 -179.457 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.596 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.8 mptt -70.53 13.54 0.17 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.049 -1.032 . . . . 0.0 113.207 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.84 -90.21 0.02 OUTLIER Glycine 0 N--CA 1.488 2.119 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -85.67 30.02 0.67 Allowed 'General case' 0 C--N 1.293 -1.883 0 O-C-N 121.874 -0.78 . . . . 0.0 110.521 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -88.28 -54.53 2.4 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.467 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.284 -2.245 0 CA-C-O 121.373 0.606 . . . . 0.0 110.381 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo . . . . . 0 N--CA 1.482 0.808 0 N-CA-C 110.928 -0.451 . . . . 0.0 110.928 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.45 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.6 8.91 31.83 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.214 1.483 . . . . 0.0 110.047 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.63 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.268 0.4 OUTLIER -70.66 -178.81 1.93 Allowed 'General case' 0 C--N 1.266 -3.022 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.772 179.784 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.661 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.63 -18.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.774 -1.204 . . . . 0.0 113.574 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.495 ' HA ' HD23 ' A' ' 39' ' ' LEU . 32.5 t70 -106.67 -70.97 0.77 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.384 -1.447 . . . . 0.0 110.506 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.506 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 6.4 mt-10 -63.25 -14.25 47.33 Favored 'General case' 0 C--N 1.283 -2.299 0 CA-C-O 122.25 1.024 . . . . 0.0 108.388 178.092 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.661 ' CE1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.37 -18.51 52.24 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.405 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.35 -57.0 3.77 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.169 179.725 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.68 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.1 mm? -61.46 -37.49 83.77 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.554 -0.716 . . . . 0.0 109.508 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.41 -33.05 5.56 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.677 -1.265 . . . . 0.0 108.006 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.403 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -90.79 -20.19 22.63 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.916 -0.49 . . . . 0.0 111.347 179.79 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.68 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -43.18 -45.86 5.75 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.22 -0.925 . . . . 0.0 109.728 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.646 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 8.4 mptt -78.53 13.13 1.7 Allowed 'General case' 0 C--N 1.308 -1.237 0 O-C-N 121.333 -0.854 . . . . 0.0 111.83 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -74.2 -91.35 0.15 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -99.42 61.94 1.21 Allowed 'General case' 0 C--N 1.295 -1.767 0 O-C-N 121.695 -0.885 . . . . 0.0 109.705 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -139.8 -72.31 0.04 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.669 -1.773 . . . . 0.0 108.669 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.896 0 CA-C-O 121.386 0.612 . . . . 0.0 111.982 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo . . . . . 0 N--CA 1.482 0.827 0 CA-C-O 121.246 0.436 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -99.36 10.29 41.68 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 123.271 1.51 . . . . 0.0 109.843 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.594 ' CD ' ' HB2' ' A' ' 38' ' ' TYR 0.266 0.1 OUTLIER -81.64 91.25 6.39 Favored 'General case' 0 C--N 1.267 -3.017 0 CA-C-N 113.798 -1.546 . . . . 0.0 110.177 179.824 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.641 ' CA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -154.5 -30.72 0.11 Allowed 'General case' 0 C--N 1.291 -1.96 0 O-C-N 121.642 -0.661 . . . . 0.0 110.569 -179.792 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 2.9 t0 -107.19 -68.72 0.88 Allowed 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -13.39 59.91 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.654 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -80.33 -19.89 45.49 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.202 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.58 -56.53 5.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.166 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.88 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.1 mm? -60.78 -35.58 76.8 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.739 0.78 . . . . 0.0 109.839 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -46.85 -38.97 11.14 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 120.847 -1.158 . . . . 0.0 108.555 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -90.82 -17.46 26.55 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.715 -0.616 . . . . 0.0 111.722 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.88 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.3 m-85 -44.66 -40.01 5.53 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 110.977 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.6 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -68.76 14.55 0.07 Allowed 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.47 -103.35 2.84 Favored Glycine 0 C--N 1.288 -2.137 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.024 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.91 65.73 0.64 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.904 0.859 . . . . 0.0 109.956 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -142.68 -75.84 0.04 OUTLIER Glycine 0 N--CA 1.485 1.905 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.634 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.3 OUTLIER . . . . . 0 C--N 1.293 -1.85 0 CA-C-O 121.398 0.618 . . . . 0.0 111.283 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.502 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.3 Cg_endo . . . . . 0 N--CA 1.483 0.89 0 CA-C-O 121.348 0.478 . . . . 0.0 111.28 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.524 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -93.88 12.87 24.44 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 123.279 1.514 . . . . 0.0 110.088 -179.557 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.563 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.26 0.1 OUTLIER -60.67 157.19 15.1 Favored 'General case' 0 C--N 1.265 -3.07 0 CA-C-N 113.957 -1.474 . . . . 0.0 110.641 179.473 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.672 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -165.5 -27.04 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.928 -1.108 . . . . 0.0 111.797 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.4 OUTLIER -97.33 -70.85 0.7 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.915 -1.115 . . . . 0.0 109.774 179.488 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -63.55 -14.65 53.32 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 122.005 0.907 . . . . 0.0 108.667 178.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.765 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -78.58 -19.79 51.99 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.266 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -45.62 -56.04 5.65 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.214 -0.929 . . . . 0.0 108.994 178.619 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.96 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -62.37 -24.83 67.58 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 121.844 0.831 . . . . 0.0 109.758 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -55.22 -44.76 75.73 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.085 -1.009 . . . . 0.0 108.567 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.433 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.1 OUTLIER -89.49 -17.78 27.99 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.382 0.61 . . . . 0.0 110.998 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.96 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -41.05 -44.31 2.39 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.419 -0.8 . . . . 0.0 110.335 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.619 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 12.0 mptt -73.0 14.37 0.29 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.043 -1.036 . . . . 0.0 113.151 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -156.46 -99.24 0.16 Allowed Glycine 0 N--CA 1.489 2.225 0 C-N-CA 119.491 -1.337 . . . . 0.0 111.702 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.45 58.85 3.27 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.677 -0.896 . . . . 0.0 110.252 -178.575 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.73 -67.35 0.1 OUTLIER Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.202 -1.959 . . . . 0.0 108.202 179.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.901 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.424 ' O ' ' N ' ' A' ' 26' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.21 0.528 . . . . 0.0 110.127 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -42.78 99.26 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.281 -0.887 . . . . 0.0 110.341 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -178.68 101.19 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.276 -0.89 . . . . 0.0 110.466 179.661 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.467 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 41.92 87.32 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.353 -0.842 . . . . 0.0 110.66 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.467 ' O ' ' O ' ' A' ' 27' ' ' GLU . 1.7 mttt -55.11 -164.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.3 -0.875 . . . . 0.0 110.222 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -45.75 148.59 0.73 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.215 -0.928 . . . . 0.0 110.444 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 31' ' ' GLY . 0.2 OUTLIER -48.87 137.17 12.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 110.712 -179.699 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.465 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 41.26 -165.34 0.01 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 110.326 -1.109 . . . . 0.0 110.326 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.64 160.31 48.67 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 124.219 1.642 . . . . 0.0 111.217 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.451 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.95 14.67 31.31 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-O 123.021 1.391 . . . . 0.0 110.171 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.577 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.258 0.1 OUTLIER -56.35 159.9 3.35 Favored 'General case' 0 C--N 1.267 -2.993 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.66 179.75 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.698 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -163.5 -19.74 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.954 -1.091 . . . . 0.0 113.142 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -103.09 -70.42 0.76 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.43 -1.419 . . . . 0.0 110.024 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.01 -13.77 60.48 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.18 0.99 . . . . 0.0 108.506 178.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.791 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.9 -20.01 53.67 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.236 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.679 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.54 -55.82 5.81 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.197 -0.939 . . . . 0.0 108.762 178.904 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.878 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.8 mm? -58.77 -25.89 63.49 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 121.679 0.752 . . . . 0.0 109.489 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.791 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -62.99 -50.57 70.21 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -86.89 -14.53 41.68 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.629 -0.67 . . . . 0.0 110.464 179.688 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.878 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.6 OUTLIER -40.32 -42.36 1.53 Allowed 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 121.38 0.609 . . . . 0.0 110.239 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -75.76 13.63 0.79 Allowed 'General case' 0 C--N 1.307 -1.28 0 O-C-N 121.322 -0.861 . . . . 0.0 112.77 -178.839 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -131.64 -104.99 1.0 Allowed Glycine 0 C--N 1.288 -2.111 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.603 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 1.9 m-20 -91.29 33.04 0.99 Allowed 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.67 -0.9 . . . . 0.0 110.991 -178.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.626 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -84.4 -48.55 5.0 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 108.398 -1.881 . . . . 0.0 108.398 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.501 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -57.87 -46.79 87.33 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.325 0 CA-C-N 114.521 -0.84 . . . . 0.0 111.012 179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 1.1 ptpt -42.93 -59.37 2.02 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.136 -0.977 . . . . 0.0 111.795 -178.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.752 ' CD1' HD12 ' A' ' 54' ' ' LEU . 5.5 p90 -86.26 -28.19 23.95 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 120.579 -1.325 . . . . 0.0 110.6 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.662 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -48.71 -54.31 15.36 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.645 -1.284 . . . . 0.0 109.029 179.203 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.634 ' O ' HG23 ' A' ' 57' ' ' ILE . . . -53.34 -53.85 45.0 Favored 'General case' 0 C--N 1.285 -2.198 0 CA-C-O 122.522 1.153 . . . . 0.0 110.486 179.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.501 ' HA ' HG12 ' A' ' 57' ' ' ILE . 23.7 mtmt -67.39 -53.32 30.27 Favored 'General case' 0 C--N 1.284 -2.251 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.792 -178.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.752 HD12 ' CD1' ' A' ' 50' ' ' TYR . 33.4 mt -51.21 -21.63 2.17 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 120.817 -1.177 . . . . 0.0 110.756 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.704 HG22 ' N ' ' A' ' 56' ' ' GLY 0.329 0.3 OUTLIER -75.52 -57.97 5.39 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 CA-C-O 121.508 0.67 . . . . 0.0 109.751 179.721 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.704 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 133.8 50.97 0.08 OUTLIER Glycine 0 C--N 1.303 -1.267 0 N-CA-C 110.402 -1.079 . . . . 0.0 110.402 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.634 HG23 ' O ' ' A' ' 52' ' ' ALA 0.264 4.4 pt -78.16 -122.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.167 0 CA-C-O 122.68 1.228 . . . . 0.0 110.075 179.752 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--N 1.259 -3.334 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.275 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.257 0.551 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.69 157.51 0.76 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.253 -0.904 . . . . 0.0 110.53 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.486 ' O ' ' O ' ' A' ' 27' ' ' GLU . 6.9 mmtm -63.5 -11.35 23.28 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.293 -0.879 . . . . 0.0 110.644 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.536 ' O ' ' N ' ' A' ' 29' ' ' LYS . 27.3 tp10 57.89 125.77 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.444 -0.785 . . . . 0.0 110.443 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -40.89 90.45 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.314 -0.866 . . . . 0.0 111.323 -179.738 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' A' ' 27' ' ' GLU . 0.6 OUTLIER -57.19 170.65 0.46 Allowed 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.193 -0.942 . . . . 0.0 110.308 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.524 ' O ' ' CG ' ' A' ' 30' ' ' LYS . 11.7 pttt -50.85 91.22 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.28 -0.888 . . . . 0.0 110.96 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.473 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 51.17 172.42 0.01 OUTLIER Glycine 0 N--CA 1.487 2.085 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 179.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -70.13 156.41 62.44 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 124.005 1.529 . . . . 0.0 111.026 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -96.28 13.87 26.11 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 123.14 1.447 . . . . 0.0 109.833 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.557 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.255 4.5 mmtp -70.54 157.0 38.67 Favored 'General case' 0 C--N 1.267 -2.978 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.785 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.622 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -167.19 -27.08 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 O-C-N 121.086 -1.009 . . . . 0.0 111.779 179.595 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.519 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.7 t70 -101.64 -69.96 0.76 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.04 -1.037 . . . . 0.0 109.522 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.547 ' CB ' ' HE2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -61.35 -16.13 43.1 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-O 122.077 0.942 . . . . 0.0 108.568 178.234 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.734 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -78.47 -18.98 54.08 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.298 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.597 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.39 -57.12 4.29 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.271 -0.893 . . . . 0.0 109.545 179.284 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.786 HD13 ' CG ' ' A' ' 43' ' ' PHE . 2.2 mm? -61.53 -32.75 72.82 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.549 -0.719 . . . . 0.0 109.717 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.734 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -44.36 -32.47 1.34 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 120.934 -1.104 . . . . 0.0 108.67 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -91.22 -16.91 26.89 Favored 'General case' 0 C--N 1.309 -1.192 0 O-C-N 121.729 -0.607 . . . . 0.0 111.649 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.786 ' CG ' HD13 ' A' ' 40' ' ' LEU . 1.4 m-85 -48.68 -17.61 0.19 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.291 -0.881 . . . . 0.0 111.41 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.8 OUTLIER -68.58 13.45 0.1 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.941 -1.099 . . . . 0.0 113.269 -178.608 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.508 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -89.32 -93.72 1.12 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.479 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -99.46 60.59 1.15 Allowed 'General case' 0 C--N 1.297 -1.691 0 O-C-N 121.709 -0.877 . . . . 0.0 109.541 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.568 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -141.57 -77.48 0.05 OUTLIER Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.136 -1.586 . . . . 0.0 109.136 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.427 ' CG1' ' HA ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -55.06 -44.42 74.2 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.745 0 O-C-N 122.103 -0.645 . . . . 0.0 110.903 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 1.9 ptpt -41.56 -59.3 1.65 Allowed 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.369 -0.832 . . . . 0.0 111.657 -178.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.684 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.5 p90 -92.17 -27.85 17.43 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.402 -1.436 . . . . 0.0 110.967 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.684 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -45.27 -56.19 5.13 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 120.885 -1.134 . . . . 0.0 109.601 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.529 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -61.02 -53.35 58.24 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-O 122.576 1.179 . . . . 0.0 110.758 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.453 ' HB2' ' HA ' ' A' ' 50' ' ' TYR . 10.7 mttt -58.17 -51.51 69.42 Favored 'General case' 0 C--N 1.283 -2.325 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.96 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 40.3 mt -51.13 -27.84 9.46 Favored 'General case' 0 C--N 1.309 -1.183 0 O-C-N 120.689 -1.257 . . . . 0.0 110.883 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.686 HG22 ' N ' ' A' ' 56' ' ' GLY 0.329 0.3 OUTLIER -75.58 -56.44 8.61 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.993 0 CA-C-O 121.683 0.754 . . . . 0.0 109.887 179.564 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.686 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 121.99 48.33 0.27 Allowed Glycine 0 C--N 1.302 -1.352 0 N-CA-C 109.886 -1.285 . . . . 0.0 109.886 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.541 HG23 HG22 ' A' ' 55' ' ' ILE 0.263 1.9 pt -74.77 -120.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 CA-C-O 122.641 1.21 . . . . 0.0 110.177 179.939 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.424 ' H ' HD12 ' A' ' 57' ' ' ILE . 16.9 t70 . . . . . 0 C--N 1.259 -3.329 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.281 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.332 0.587 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.41 ' O ' ' C ' ' A' ' 26' ' ' LYS . 9.8 mmtt -49.75 145.12 5.52 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.223 -0.923 . . . . 0.0 110.785 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' A' ' 27' ' ' GLU . 1.8 tptt -42.28 -65.35 0.47 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.395 -0.816 . . . . 0.0 110.287 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.466 ' O ' ' O ' ' A' ' 26' ' ' LYS . 13.6 tp10 54.37 164.89 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.342 -0.849 . . . . 0.0 110.218 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.457 ' O ' ' O ' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -50.35 -178.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.281 -0.887 . . . . 0.0 111.036 -179.446 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -54.12 -161.16 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 121.696 0.76 . . . . 0.0 111.154 -179.85 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' GLY . 0.0 OUTLIER -51.84 -166.82 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 121.588 0.709 . . . . 0.0 111.15 -179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -53.54 -163.2 0.01 OUTLIER Glycine 0 N--CA 1.486 1.997 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.516 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 41.2 Cg_endo -66.28 -167.22 0.12 Allowed 'Trans proline' 0 C--N 1.303 -1.837 0 O-C-N 124.166 1.614 . . . . 0.0 111.367 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.16 10.69 23.51 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.886 1.326 . . . . 0.0 110.537 -179.271 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 38' ' ' TYR 0.258 0.0 OUTLIER -63.33 114.79 4.04 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.035 179.552 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.679 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -140.44 -13.84 1.0 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 118.931 -1.107 . . . . 0.0 112.418 -179.414 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.463 ' HA ' HD23 ' A' ' 39' ' ' LEU . 63.8 t0 -107.1 -70.32 0.8 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.153 -0.967 . . . . 0.0 109.785 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -63.2 -15.78 58.05 Favored 'General case' 0 C--N 1.283 -2.319 0 CA-C-O 122.207 1.004 . . . . 0.0 108.466 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.679 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.97 -18.61 49.9 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.673 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.23 -56.99 4.96 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.156 -0.965 . . . . 0.0 109.588 179.636 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.895 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -61.16 -35.93 78.46 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.471 -0.768 . . . . 0.0 109.59 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.675 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -46.25 -35.36 5.16 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.952 -1.093 . . . . 0.0 108.5 178.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -90.82 -18.34 25.05 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.804 -0.56 . . . . 0.0 111.44 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.895 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.2 m-85 -45.73 -26.62 0.67 Allowed 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.164 -0.96 . . . . 0.0 110.235 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.628 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.6 mptp? -75.67 13.37 0.82 Allowed 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.351 -0.843 . . . . 0.0 112.559 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.498 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -86.3 -95.09 0.83 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.444 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -95.11 59.62 2.28 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.751 -0.853 . . . . 0.0 109.56 -179.931 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.523 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -139.31 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.485 1.959 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.428 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -53.45 -45.39 57.77 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.801 0 CA-C-O 121.456 0.646 . . . . 0.0 111.328 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -41.36 -58.79 1.75 Allowed 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.504 -0.747 . . . . 0.0 111.981 -177.888 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.66 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.1 p90 -91.95 -27.14 18.07 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.341 -1.474 . . . . 0.0 111.39 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.66 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -54.46 -44.47 72.59 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 120.662 -1.273 . . . . 0.0 109.576 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.505 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -58.45 -54.1 50.81 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-O 122.474 1.131 . . . . 0.0 110.19 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.4 mtpp -69.11 -54.09 16.83 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.933 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 29.9 mt -51.59 -21.73 2.78 Favored 'General case' 0 C--N 1.308 -1.197 0 O-C-N 120.84 -1.162 . . . . 0.0 110.34 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 1.055 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -76.12 -59.19 3.42 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 CA-C-O 121.585 0.707 . . . . 0.0 109.849 179.809 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.714 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 84.54 52.96 3.37 Favored Glycine 0 N--CA 1.479 1.5 0 C-N-CA 120.266 -0.969 . . . . 0.0 111.496 178.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.055 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.255 1.5 pt -71.88 -119.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 CA-C-O 122.595 1.188 . . . . 0.0 110.058 179.266 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.513 ' H ' HD12 ' A' ' 57' ' ' ILE . 31.7 t70 . . . . . 0 C--N 1.26 -3.311 0 CA-C-N 114.673 -1.148 . . . . 0.0 110.528 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.415 ' O ' ' C ' ' A' ' 25' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 121.262 0.554 . . . . 0.0 110.258 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.53 ' O ' ' N ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER 43.43 -159.76 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 110.325 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.5 tptt -42.9 90.49 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.465 -0.772 . . . . 0.0 110.766 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 25' ' ' LYS . 3.5 pt-20 -60.58 158.62 12.04 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 121.231 -0.918 . . . . 0.0 110.781 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 14.7 tttp -50.56 131.47 25.17 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.345 -0.847 . . . . 0.0 110.558 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 31' ' ' GLY . 10.6 ttpp -44.5 108.45 0.12 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.249 -0.907 . . . . 0.0 110.469 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.472 ' O ' ' O ' ' A' ' 31' ' ' GLY . 0.0 OUTLIER -62.16 73.21 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.282 -0.886 . . . . 0.0 110.522 -179.81 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 29' ' ' LYS . . . 43.73 -168.56 0.02 OUTLIER Glycine 0 N--CA 1.485 1.962 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.37 167.99 22.33 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.035 1.545 . . . . 0.0 111.161 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.488 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -95.38 17.0 15.36 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 123.198 1.475 . . . . 0.0 109.473 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.575 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.259 0.1 OUTLIER -50.94 151.62 2.48 Favored 'General case' 0 C--N 1.269 -2.902 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.02 179.966 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.626 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -157.45 -27.0 0.09 Allowed 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.207 -0.933 . . . . 0.0 111.975 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -98.58 -69.79 0.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.921 -1.112 . . . . 0.0 109.579 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HA ' ' OE1' ' A' ' 37' ' ' GLU . 1.9 mm-40 -61.88 -15.04 39.4 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 121.965 0.888 . . . . 0.0 109.056 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.731 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -80.68 -19.28 45.52 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.876 -179.51 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.671 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.9 -56.46 5.41 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 120.99 -1.069 . . . . 0.0 109.343 178.742 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.773 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -60.33 -34.75 74.27 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.69 0.757 . . . . 0.0 109.734 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.731 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.61 -35.64 1.83 Allowed 'General case' 0 C--N 1.3 -1.551 0 O-C-N 120.902 -1.124 . . . . 0.0 108.746 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -90.76 -19.1 23.88 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.712 -0.617 . . . . 0.0 111.417 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.773 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -46.46 -38.61 9.38 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.206 -0.934 . . . . 0.0 110.32 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.0 OUTLIER -75.19 13.2 0.75 Allowed 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.345 -0.847 . . . . 0.0 112.796 -178.47 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.46 -94.69 0.1 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.609 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 2.5 m-20 -76.21 38.33 0.17 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.628 -0.924 . . . . 0.0 111.419 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.607 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -88.46 -50.32 3.42 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 108.142 -1.983 . . . . 0.0 108.142 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.454 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -56.25 -45.38 81.12 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.138 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.079 179.616 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.562 ' HE3' ' N ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -42.28 -59.94 1.65 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.301 -0.874 . . . . 0.0 111.73 -177.94 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.685 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.4 p90 -87.25 -27.55 22.87 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 120.272 -1.518 . . . . 0.0 110.684 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.685 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 9.5 mmtt -47.29 -56.52 6.64 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 120.883 -1.136 . . . . 0.0 109.394 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.517 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -49.87 -53.72 23.99 Favored 'General case' 0 C--N 1.283 -2.288 0 CA-C-O 122.427 1.108 . . . . 0.0 110.639 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.6 mttm -67.77 -52.84 32.54 Favored 'General case' 0 C--N 1.284 -2.276 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.033 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.54 HD12 ' CD1' ' A' ' 50' ' ' TYR . 27.3 mt -50.98 -20.79 1.47 Allowed 'General case' 0 C--N 1.308 -1.21 0 O-C-N 120.731 -1.23 . . . . 0.0 110.908 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.714 HG22 ' N ' ' A' ' 56' ' ' GLY 0.329 0.3 OUTLIER -75.13 -57.42 6.44 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 CA-C-O 121.478 0.656 . . . . 0.0 109.897 179.666 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.714 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 129.72 51.06 0.11 Allowed Glycine 0 N--CA 1.475 1.273 0 C-N-CA 120.098 -1.049 . . . . 0.0 110.772 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 52' ' ' ALA 0.263 2.4 pt -75.97 -120.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.138 0 CA-C-O 122.617 1.199 . . . . 0.0 110.018 179.504 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.44 ' OXT' ' O ' ' A' ' 57' ' ' ILE . 5.1 t0 . . . . . 0 C--N 1.259 -3.359 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.146 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.409 0.623 . . . . 0.0 110.0 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.404 ' O ' ' CG ' ' A' ' 25' ' ' LYS . 11.9 ptmt -45.57 112.01 0.41 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.257 -0.902 . . . . 0.0 110.581 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.451 ' O ' ' C ' ' A' ' 27' ' ' GLU . 1.4 ttmt -51.27 104.34 0.08 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.193 -0.942 . . . . 0.0 110.178 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.527 ' OE2' ' N ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -36.68 102.94 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.619 -0.676 . . . . 0.0 111.042 -179.699 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 29' ' ' LYS . 0.6 OUTLIER -41.14 -34.21 0.43 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.261 -0.899 . . . . 0.0 110.252 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -50.73 -174.26 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.376 -0.827 . . . . 0.0 110.362 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' A' ' 31' ' ' GLY . 3.9 mttt -43.64 123.19 3.01 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.148 -0.97 . . . . 0.0 110.075 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.463 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -44.31 169.99 0.01 OUTLIER Glycine 0 N--CA 1.486 2.019 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -67.98 -173.46 0.51 Allowed 'Trans proline' 0 C--N 1.303 -1.829 0 O-C-N 124.082 1.57 . . . . 0.0 110.756 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.544 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.46 2.08 53.52 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 123.145 1.45 . . . . 0.0 110.166 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.513 ' HD3' ' HB3' ' A' ' 38' ' ' TYR 0.251 1.3 mmtp -67.91 153.77 43.0 Favored 'General case' 0 C--N 1.264 -3.139 0 CA-C-N 113.997 -1.456 . . . . 0.0 110.046 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.679 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.09 -24.67 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.05 -1.031 . . . . 0.0 112.236 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -70.75 0.71 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.916 -1.115 . . . . 0.0 110.014 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.73 -13.35 54.44 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-O 122.002 0.906 . . . . 0.0 108.765 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.791 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.57 -19.58 49.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.428 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -47.47 -56.64 6.61 Favored 'General case' 0 C--N 1.306 -1.283 0 O-C-N 121.065 -1.022 . . . . 0.0 109.152 178.893 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.612 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 1.8 mm? -58.64 -34.15 70.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.856 0.836 . . . . 0.0 109.219 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.791 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.22 -35.87 8.13 Favored 'General case' 0 C--N 1.297 -1.716 0 O-C-N 120.928 -1.108 . . . . 0.0 108.049 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.462 ' HD3' ' OD1' ' A' ' 46' ' ' ASP . 3.4 mtt180 -90.5 -20.61 22.49 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 121.809 -0.557 . . . . 0.0 111.452 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.612 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.1 m-85 -42.66 -34.83 0.96 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.205 -0.934 . . . . 0.0 109.965 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.5 mptt -77.81 13.29 1.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.416 -0.803 . . . . 0.0 112.224 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.474 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -151.54 -96.01 0.13 Allowed Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.51 ' HA ' ' CD ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -84.35 55.78 3.5 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.716 -0.873 . . . . 0.0 109.284 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -129.88 -77.82 0.19 Allowed Glycine 0 N--CA 1.487 2.099 0 N-CA-C 108.379 -1.889 . . . . 0.0 108.379 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.458 HG12 ' H ' ' A' ' 48' ' ' VAL . 0.2 OUTLIER -54.12 -41.64 51.9 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.825 0 O-C-N 122.003 -0.704 . . . . 0.0 110.499 179.189 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' CD ' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -41.12 -59.45 1.49 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.675 -0.641 . . . . 0.0 112.069 -177.776 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.67 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 4.1 p90 -91.28 -28.58 17.68 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.279 -1.513 . . . . 0.0 111.293 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.67 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -53.9 -44.06 70.2 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.522 -1.362 . . . . 0.0 109.44 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.526 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -71.16 -52.09 21.17 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.643 1.211 . . . . 0.0 110.087 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.501 ' HB2' ' HA ' ' A' ' 50' ' ' TYR . 44.8 mttt -58.89 -52.53 65.34 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.729 -179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 46.4 mt -51.44 -27.78 11.23 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 120.733 -1.23 . . . . 0.0 110.836 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.689 HG22 ' N ' ' A' ' 56' ' ' GLY 0.331 0.3 OUTLIER -75.21 -55.21 12.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 CA-C-O 121.591 0.71 . . . . 0.0 110.15 -179.89 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.689 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 110.35 51.5 0.62 Allowed Glycine 0 C--N 1.3 -1.464 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.665 HG23 HG22 ' A' ' 55' ' ' ILE 0.262 2.4 pt -72.68 -119.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.232 0 CA-C-O 122.527 1.156 . . . . 0.0 110.271 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.422 ' C ' ' O ' ' A' ' 57' ' ' ILE . 27.0 t0 . . . . . 0 C--N 1.26 -3.291 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.452 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.439 ' O ' ' C ' ' A' ' 25' ' ' LYS . 13.5 p . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.142 0.496 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' A' ' 26' ' ' LYS . 2.2 tmtm? -41.28 -57.54 2.1 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.335 -0.853 . . . . 0.0 110.316 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.475 ' O ' ' O ' ' A' ' 27' ' ' GLU . 0.2 OUTLIER 49.4 -179.1 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.17 -0.956 . . . . 0.0 109.957 179.63 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 26' ' ' LYS . 1.7 tt0 -52.19 -172.16 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.211 -0.931 . . . . 0.0 109.772 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.522 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -41.08 163.33 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.263 -0.898 . . . . 0.0 110.177 179.716 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 tttp -64.56 58.43 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.194 -0.942 . . . . 0.0 111.05 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 28' ' ' LYS . 14.6 ptpt -50.35 150.51 2.53 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.068 -1.02 . . . . 0.0 110.717 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -56.2 -160.58 0.02 OUTLIER Glycine 0 N--CA 1.483 1.771 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.548 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.2 Cg_endo -65.16 -164.98 0.07 OUTLIER 'Trans proline' 0 C--N 1.301 -1.938 0 O-C-N 124.31 1.689 . . . . 0.0 111.065 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.446 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.6 9.34 16.36 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.908 1.337 . . . . 0.0 111.039 -178.827 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.563 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.262 0.0 OUTLIER -60.72 161.22 8.17 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.22 179.352 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.658 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -163.79 -26.66 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.724 -1.235 . . . . 0.0 112.402 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -97.17 -70.55 0.71 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.794 -1.191 . . . . 0.0 110.104 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.1 -13.78 50.13 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.968 0.889 . . . . 0.0 109.022 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.781 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.88 -19.52 48.06 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.186 -179.434 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.734 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -49.31 -55.69 11.98 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 120.804 -1.185 . . . . 0.0 108.793 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.663 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -59.19 -25.76 64.23 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.932 0.872 . . . . 0.0 109.341 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.781 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -54.3 -37.58 64.95 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 120.957 -1.09 . . . . 0.0 108.197 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' LYS . 18.3 mmm180 -90.23 -18.33 25.88 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.412 0.625 . . . . 0.0 111.187 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.663 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.1 m-85 -43.33 -23.12 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.311 -0.868 . . . . 0.0 110.799 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.53 12.81 0.56 Allowed 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.108 -0.995 . . . . 0.0 112.441 -178.994 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.506 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -74.0 -84.16 0.31 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 110.089 -1.204 . . . . 0.0 110.089 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.494 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -94.25 59.39 2.61 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.617 0.722 . . . . 0.0 109.484 -179.896 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.539 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -139.83 -76.98 0.05 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.438 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -53.19 -45.06 54.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 O-C-N 122.094 -0.65 . . . . 0.0 110.702 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.2 OUTLIER -41.64 -59.35 1.66 Allowed 'General case' 0 C--N 1.297 -1.698 0 O-C-N 121.458 -0.776 . . . . 0.0 111.59 -178.333 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.66 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.5 p90 -92.77 -26.69 17.61 Favored 'General case' 0 C--N 1.307 -1.262 0 O-C-N 120.307 -1.496 . . . . 0.0 110.719 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.66 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 4.0 mmtt -48.82 -47.71 42.19 Favored 'General case' 0 C--N 1.305 -1.334 0 O-C-N 120.834 -1.166 . . . . 0.0 109.306 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.516 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -62.03 -54.45 41.37 Favored 'General case' 0 C--N 1.286 -2.192 0 CA-C-O 122.43 1.109 . . . . 0.0 109.89 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -53.29 59.87 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.228 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 31.3 mt -51.3 -28.36 11.86 Favored 'General case' 0 C--N 1.308 -1.214 0 O-C-N 120.88 -1.137 . . . . 0.0 110.503 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.699 HG22 ' N ' ' A' ' 56' ' ' GLY 0.331 0.2 OUTLIER -75.25 -56.71 7.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 CA-C-O 121.552 0.691 . . . . 0.0 110.029 179.654 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.699 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 123.65 50.2 0.21 Allowed Glycine 0 C--N 1.302 -1.357 0 N-CA-C 110.236 -1.146 . . . . 0.0 110.236 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.455 HD13 ' HB1' ' A' ' 52' ' ' ALA 0.259 3.5 pt -73.93 -119.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.168 0 CA-C-O 122.602 1.192 . . . . 0.0 110.239 179.734 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 t0 . . . . . 0 C--N 1.26 -3.311 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.105 -179.717 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 25' ' ' LYS . 94.7 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.192 0.52 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.447 ' O ' ' O ' ' A' ' 24' ' ' SER . 0.0 OUTLIER 54.54 166.26 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.308 -0.87 . . . . 0.0 110.239 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 27' ' ' GLU . 1.3 mmtt -52.51 178.1 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.283 -0.885 . . . . 0.0 110.548 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.462 ' O ' ' O ' ' A' ' 26' ' ' LYS . 0.9 OUTLIER 56.82 119.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.533 -0.73 . . . . 0.0 110.952 179.539 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.474 ' O ' ' O ' ' A' ' 29' ' ' LYS . 10.0 tptp -50.01 179.6 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.472 -0.767 . . . . 0.0 110.458 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.538 ' O ' ' N ' ' A' ' 31' ' ' GLY . 1.9 ttpm? -38.06 160.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.604 -0.685 . . . . 0.0 110.742 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 31' ' ' GLY . 7.6 mmtt -42.32 91.87 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.35 -0.844 . . . . 0.0 110.529 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.538 ' N ' ' O ' ' A' ' 29' ' ' LYS . . . -52.15 -173.28 0.03 OUTLIER Glycine 0 N--CA 1.485 1.9 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.53 -170.09 0.24 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.075 1.566 . . . . 0.0 110.734 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.533 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -91.18 7.3 41.36 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 123.234 1.492 . . . . 0.0 110.271 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.546 ' NZ ' ' HB2' ' A' ' 37' ' ' GLU 0.259 0.3 OUTLIER -73.44 138.08 44.96 Favored 'General case' 0 C--N 1.263 -3.166 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.446 179.742 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.625 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -170.76 -25.99 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.257 -0.902 . . . . 0.0 111.403 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -102.79 -69.74 0.78 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.139 -0.976 . . . . 0.0 109.059 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.546 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 4.7 mt-10 -63.13 -15.1 55.66 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.73 -19.52 52.16 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.326 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.585 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -45.64 -56.35 5.3 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.121 -0.987 . . . . 0.0 109.541 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.823 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -62.73 -37.94 88.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.58 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.81 -39.28 8.18 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.823 -1.173 . . . . 0.0 108.792 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.446 ' HD3' ' HB2' ' A' ' 46' ' ' ASP . 8.0 mtt180 -91.0 -17.21 26.66 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.714 -0.616 . . . . 0.0 111.767 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.823 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.5 m-85 -44.16 -42.28 6.3 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.217 -0.927 . . . . 0.0 110.96 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -73.34 12.93 0.5 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.191 -0.943 . . . . 0.0 112.966 -178.58 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -160.27 -96.66 0.11 Allowed Glycine 0 C--N 1.286 -2.217 0 C-N-CA 120.013 -1.089 . . . . 0.0 110.404 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.622 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.9 m-20 -75.55 36.44 0.13 Allowed 'General case' 0 C--N 1.296 -1.735 0 O-C-N 121.617 -0.931 . . . . 0.0 112.011 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.618 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -88.57 -50.12 3.45 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.415 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -57.45 -46.07 85.74 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.214 0 CA-C-N 114.763 -0.718 . . . . 0.0 110.884 179.667 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.622 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -42.92 -59.39 2.01 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.394 -0.816 . . . . 0.0 112.436 -178.144 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.679 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 7.3 p90 -81.04 -36.05 31.05 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 120.349 -1.469 . . . . 0.0 111.145 -179.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.679 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -54.4 -45.31 72.88 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.24 -1.538 . . . . 0.0 108.749 178.869 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.52 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -64.19 -53.28 51.83 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.462 1.125 . . . . 0.0 110.534 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -67.22 -51.04 58.14 Favored 'General case' 0 C--N 1.283 -2.316 0 CA-C-N 115.228 -0.896 . . . . 0.0 112.098 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 40.9 mt -50.84 -21.23 1.58 Allowed 'General case' 0 C--N 1.308 -1.224 0 O-C-N 120.759 -1.213 . . . . 0.0 110.947 -178.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 1.021 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -74.88 -56.43 8.92 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.984 0 CA-C-O 121.601 0.715 . . . . 0.0 109.526 179.445 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.677 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 85.79 53.58 2.99 Favored Glycine 0 N--CA 1.477 1.416 0 C-N-CA 119.983 -1.103 . . . . 0.0 111.113 178.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.021 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.253 1.9 pt -70.85 -118.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.223 0 CA-C-O 122.611 1.196 . . . . 0.0 109.918 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.432 ' C ' ' O ' ' A' ' 57' ' ' ILE . 6.3 t70 . . . . . 0 C--N 1.258 -3.373 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.267 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.7 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.421 0.629 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.457 ' O ' ' O ' ' A' ' 26' ' ' LYS . 0.8 OUTLIER -65.2 -9.8 26.34 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.221 -0.925 . . . . 0.0 110.698 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.482 ' HB3' ' OE2' ' A' ' 27' ' ' GLU . 0.7 OUTLIER -49.83 -177.88 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.909 . . . . 0.0 110.769 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.482 ' OE2' ' HB3' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -43.25 141.86 1.18 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.39 -0.819 . . . . 0.0 110.891 -179.607 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -59.92 -166.05 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.281 -0.887 . . . . 0.0 110.645 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -44.96 174.05 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.432 -0.792 . . . . 0.0 110.622 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 29' ' ' LYS . 1.7 mttm -47.33 173.79 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.239 -0.913 . . . . 0.0 110.011 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -178.32 -179.59 48.3 Favored Glycine 0 N--CA 1.474 1.217 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -69.06 163.08 39.09 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 O-C-N 123.939 1.494 . . . . 0.0 110.848 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.97 12.63 33.56 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 123.155 1.455 . . . . 0.0 109.848 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.565 ' CD ' ' HB3' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -61.49 158.39 14.99 Favored 'General case' 0 C--N 1.267 -3.0 0 CA-C-N 113.925 -1.489 . . . . 0.0 110.52 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.626 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.53 -24.92 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 O-C-N 121.028 -1.045 . . . . 0.0 112.395 179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.454 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 m-20 -100.2 -70.41 0.74 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.814 -1.179 . . . . 0.0 109.873 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -62.83 -15.1 52.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-O 122.071 0.938 . . . . 0.0 108.663 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.626 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.93 -19.27 52.21 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.348 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.589 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.06 -56.96 4.2 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.211 -0.931 . . . . 0.0 109.48 178.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.924 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -62.51 -37.99 88.19 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.614 0.721 . . . . 0.0 109.869 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.34 -37.12 10.44 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.718 -1.239 . . . . 0.0 108.461 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -19.25 23.94 Favored 'General case' 0 C--N 1.308 -1.196 0 O-C-N 121.739 -0.601 . . . . 0.0 111.5 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.924 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.5 m-30 -43.92 -44.05 6.85 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.253 -0.904 . . . . 0.0 110.436 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.658 ' HB3' HG11 ' A' ' 48' ' ' VAL . 1.6 mptm? -74.42 13.32 0.61 Allowed 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.251 -0.906 . . . . 0.0 112.321 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.527 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -52.66 -82.03 0.05 OUTLIER Glycine 0 N--CA 1.489 2.218 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.77 65.04 0.99 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-O 121.848 0.832 . . . . 0.0 109.97 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.523 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -145.12 -69.35 0.02 OUTLIER Glycine 0 N--CA 1.486 2.031 0 N-CA-C 108.389 -1.885 . . . . 0.0 108.389 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.658 HG11 ' HB3' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -66.78 -46.82 84.61 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.949 0 O-C-N 122.344 -0.504 . . . . 0.0 111.864 -179.735 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -42.03 -59.37 1.77 Allowed 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.052 -1.03 . . . . 0.0 112.173 -177.526 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.681 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.1 p90 -80.54 -30.59 37.11 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.429 -1.419 . . . . 0.0 110.615 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.681 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -51.95 -54.22 32.06 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 120.523 -1.361 . . . . 0.0 108.671 178.834 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.512 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -55.35 -54.12 47.65 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-O 122.38 1.086 . . . . 0.0 110.246 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.8 mttt -64.15 -54.12 38.77 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.574 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 54' ' ' LEU . 43.6 mt -50.56 -25.75 4.47 Favored 'General case' 0 C--N 1.31 -1.134 0 O-C-N 120.686 -1.259 . . . . 0.0 110.044 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 1.061 HG23 HG23 ' A' ' 57' ' ' ILE 0.344 0.3 OUTLIER -75.51 -64.24 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.815 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.786 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 62.76 43.03 99.56 Favored Glycine 0 N--CA 1.481 1.675 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 178.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.061 HG23 HG23 ' A' ' 55' ' ' ILE 0.254 3.1 pt -71.96 -117.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.284 -2.255 0 CA-C-O 122.512 1.148 . . . . 0.0 109.755 178.735 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.437 ' OXT' ' CG ' ' A' ' 58' ' ' ASP . 23.4 t70 . . . . . 0 C--N 1.258 -3.395 0 CA-C-O 117.948 -1.025 . . . . 0.0 109.989 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.484 ' O ' ' N ' ' A' ' 26' ' ' LYS . 4.7 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.348 0.594 . . . . 0.0 110.083 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 24' ' ' SER . 0.0 OUTLIER 65.51 -66.92 0.14 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.386 -0.821 . . . . 0.0 110.509 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -128.6 146.54 50.82 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.179 -0.951 . . . . 0.0 110.411 -179.804 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 26' ' ' LYS . 21.6 tt0 -179.06 -50.0 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.386 -0.821 . . . . 0.0 109.89 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -41.96 145.12 0.36 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.377 -0.827 . . . . 0.0 110.284 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 28' ' ' LYS . 38.0 ttpt -41.63 123.22 2.17 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.396 -0.815 . . . . 0.0 110.063 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 31' ' ' GLY . 6.5 mttt -39.56 111.28 0.18 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.522 -0.737 . . . . 0.0 110.776 -179.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -54.61 -161.56 0.01 OUTLIER Glycine 0 N--CA 1.484 1.872 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.422 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 41.3 Cg_endo -66.26 -173.17 0.33 Allowed 'Trans proline' 0 C--N 1.3 -1.987 0 O-C-N 124.109 1.584 . . . . 0.0 110.739 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.448 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.88 13.79 19.41 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 123.141 1.448 . . . . 0.0 109.841 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.576 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -64.12 153.29 38.12 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.702 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.703 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -159.64 -29.18 0.07 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.154 -0.966 . . . . 0.0 111.705 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.488 ' HA ' HD22 ' A' ' 39' ' ' LEU . 1.5 t0 -93.43 -69.82 0.73 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.161 -0.962 . . . . 0.0 109.829 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.434 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 0.8 OUTLIER -64.19 -13.64 49.98 Favored 'General case' 0 C--N 1.287 -2.144 0 CA-C-O 121.902 0.858 . . . . 0.0 109.152 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.795 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -82.84 -17.83 42.54 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 121.308 0.575 . . . . 0.0 110.076 -179.816 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.604 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -47.72 -55.59 9.2 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.212 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.806 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -58.67 -33.55 70.25 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-O 121.963 0.887 . . . . 0.0 109.095 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.795 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -48.67 -43.05 36.5 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.978 -1.076 . . . . 0.0 108.299 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 44' ' ' LYS . 2.1 mmp_? -90.61 -16.58 28.42 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.733 -0.604 . . . . 0.0 111.591 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.806 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -42.35 -24.48 0.05 Allowed 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 110.793 -179.051 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -70.93 12.87 0.23 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.092 -1.005 . . . . 0.0 112.897 -178.882 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -126.28 -104.09 1.37 Allowed Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.612 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 1.5 m-20 -82.15 35.63 0.44 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.374 -1.074 . . . . 0.0 110.819 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.604 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -89.82 -51.84 2.75 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 108.552 -1.819 . . . . 0.0 108.552 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.455 HG12 ' H ' ' A' ' 48' ' ' VAL . 0.2 OUTLIER -52.78 -45.87 50.35 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.081 0 CA-C-N 114.948 -0.626 . . . . 0.0 110.536 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 0.3 OUTLIER -43.84 -59.24 2.34 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 111.872 -178.255 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.675 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.4 p90 -89.3 -28.71 19.68 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.514 -1.366 . . . . 0.0 111.276 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.675 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -47.38 -55.78 8.21 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.698 -1.251 . . . . 0.0 109.225 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.505 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -51.94 -54.05 34.06 Favored 'General case' 0 C--N 1.284 -2.26 0 CA-C-O 122.505 1.145 . . . . 0.0 110.117 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.4 mttt -63.57 -53.1 56.98 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.719 -178.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 28.5 mt -50.29 -25.73 4.05 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 120.67 -1.269 . . . . 0.0 110.179 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 1.034 HG23 HG23 ' A' ' 57' ' ' ILE 0.339 0.3 OUTLIER -76.05 -65.76 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.864 0 CA-C-O 121.634 0.73 . . . . 0.0 109.142 178.831 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.785 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 56.96 41.7 92.24 Favored Glycine 0 N--CA 1.483 1.772 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 178.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.034 HG23 HG23 ' A' ' 55' ' ' ILE 0.252 3.3 pt -72.58 -118.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.283 -2.32 0 CA-C-O 122.575 1.179 . . . . 0.0 109.928 179.177 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.431 ' C ' ' OD1' ' A' ' 58' ' ' ASP . 16.2 t0 . . . . . 0 C--N 1.259 -3.354 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.22 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 121.272 0.558 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.9 -67.73 0.26 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.222 -0.924 . . . . 0.0 110.273 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 27' ' ' GLU . 6.2 ttmt 54.84 35.15 23.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.193 -0.942 . . . . 0.0 110.262 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -40.45 -30.45 0.11 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.419 -0.8 . . . . 0.0 110.665 -179.787 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.537 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -56.41 126.33 25.95 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.253 -0.904 . . . . 0.0 110.56 -179.734 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.537 ' C ' ' O ' ' A' ' 28' ' ' LYS . 6.9 ttmt 25.57 63.31 0.06 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.331 0.586 . . . . 0.0 111.303 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.551 ' O ' ' CG ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -63.77 60.66 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.5 -0.75 . . . . 0.0 111.244 -179.218 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 29' ' ' LYS . . . 49.04 -152.63 2.8 Favored Glycine 0 N--CA 1.485 1.908 0 C-N-CA 119.705 -1.236 . . . . 0.0 110.125 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.0 Cg_endo -63.45 -161.71 0.04 OUTLIER 'Trans proline' 0 C--N 1.3 -2.004 0 O-C-N 124.517 1.798 . . . . 0.0 111.602 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -79.32 2.38 21.69 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.909 1.338 . . . . 0.0 111.503 -178.796 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.55 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.251 0.1 OUTLIER -66.15 149.28 50.55 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.762 178.968 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.762 ' O ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -166.25 -24.87 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.993 -1.067 . . . . 0.0 112.226 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -97.2 -70.08 0.73 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.97 -1.081 . . . . 0.0 109.722 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -13.12 57.11 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 121.914 0.864 . . . . 0.0 109.031 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.702 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -81.2 -19.11 43.98 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.113 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 35' ' ' THR . 0.2 OUTLIER -50.31 -56.64 10.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.009 -1.057 . . . . 0.0 109.406 179.321 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.812 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -63.33 -32.25 73.61 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.42 -37.45 5.11 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.877 -1.139 . . . . 0.0 108.883 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.29 -18.58 25.35 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.645 -0.659 . . . . 0.0 111.5 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.812 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -44.29 -33.79 1.72 Allowed 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.093 -1.004 . . . . 0.0 110.101 -179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.617 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 9.6 mptt -77.51 12.18 1.7 Allowed 'General case' 0 C--N 1.308 -1.201 0 O-C-N 121.163 -0.96 . . . . 0.0 112.079 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -115.05 -100.72 2.32 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.618 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 5.7 m-20 -82.24 33.13 0.39 Allowed 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.509 -0.995 . . . . 0.0 110.473 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.607 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -87.46 -51.89 3.17 Favored Glycine 0 N--CA 1.485 1.933 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.462 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -52.26 -46.78 45.52 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.193 0 CA-C-N 114.972 -0.614 . . . . 0.0 110.288 179.726 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 2.3 ptpt -43.09 -59.09 2.17 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.266 -0.896 . . . . 0.0 111.536 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.629 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.4 p90 -91.1 -26.36 19.16 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.518 -1.364 . . . . 0.0 111.128 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.629 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -47.92 -53.54 15.56 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.546 -1.346 . . . . 0.0 109.017 179.585 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.743 ' O ' HG23 ' A' ' 57' ' ' ILE . . . -55.98 -53.36 57.87 Favored 'General case' 0 C--N 1.285 -2.237 0 CA-C-O 122.584 1.183 . . . . 0.0 109.987 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' HA ' HG12 ' A' ' 57' ' ' ILE . 3.1 mtpm? -61.16 -54.03 49.58 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.514 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 26.5 mt -51.3 -27.06 8.46 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 120.687 -1.258 . . . . 0.0 110.542 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.703 HG22 ' N ' ' A' ' 56' ' ' GLY 0.326 0.2 OUTLIER -75.17 -57.63 6.06 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.434 0.635 . . . . 0.0 110.223 179.817 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.703 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 134.12 51.64 0.08 OUTLIER Glycine 0 C--N 1.302 -1.344 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.743 HG23 ' O ' ' A' ' 52' ' ' ALA 0.262 4.8 pt -74.68 -120.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.2 0 CA-C-O 122.649 1.214 . . . . 0.0 110.307 -179.912 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.434 ' C ' ' O ' ' A' ' 57' ' ' ILE . 48.6 t0 . . . . . 0 C--N 1.261 -3.24 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.444 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.281 0.562 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.9 tmtp? 57.76 36.99 27.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.298 -0.876 . . . . 0.0 110.513 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.55 129.61 16.37 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.313 -0.867 . . . . 0.0 110.56 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 28' ' ' LYS . 3.2 mt-10 -53.95 -84.52 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.358 -0.839 . . . . 0.0 110.792 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.408 ' C ' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -42.13 134.08 2.88 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.287 -0.883 . . . . 0.0 111.031 -179.376 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.85 127.04 7.79 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 121.43 -0.794 . . . . 0.0 110.359 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.431 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -50.73 142.71 10.82 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.222 -0.924 . . . . 0.0 110.422 179.925 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 176.85 -172.59 45.55 Favored Glycine 0 N--CA 1.474 1.178 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -67.47 163.8 33.35 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.056 1.556 . . . . 0.0 111.167 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.49 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.9 9.93 28.44 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 123.038 1.399 . . . . 0.0 110.242 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.553 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -60.75 151.51 29.31 Favored 'General case' 0 C--N 1.267 -2.983 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.844 179.298 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.698 ' O ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -166.49 -23.15 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.987 -1.07 . . . . 0.0 112.563 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -99.59 -70.07 0.74 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.76 -1.212 . . . . 0.0 109.868 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.89 -13.95 58.17 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-O 121.992 0.901 . . . . 0.0 108.774 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.691 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.5 -19.45 49.66 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.719 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.698 HD22 ' O ' ' A' ' 35' ' ' THR . 0.2 OUTLIER -48.92 -56.99 7.18 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.173 -0.954 . . . . 0.0 109.364 179.429 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.714 HD13 ' CG ' ' A' ' 43' ' ' PHE . 2.5 mm? -61.8 -32.35 72.64 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.666 0.746 . . . . 0.0 110.001 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.55 -36.92 4.95 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 120.943 -1.098 . . . . 0.0 108.814 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.3 OUTLIER -90.53 -19.83 23.34 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.627 -0.671 . . . . 0.0 111.644 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.714 ' CG ' HD13 ' A' ' 40' ' ' LEU . 1.2 m-85 -41.98 -41.8 2.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.214 -0.929 . . . . 0.0 110.45 -179.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.616 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.87 12.98 0.57 Allowed 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.019 -1.051 . . . . 0.0 112.364 -179.32 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -87.42 -99.81 0.87 Allowed Glycine 0 C--N 1.288 -2.096 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.636 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.6 m-20 -81.14 38.69 0.48 Allowed 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.529 -0.983 . . . . 0.0 110.817 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -100.51 -63.07 0.79 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.424 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.1 OUTLIER -51.07 -43.16 25.92 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.124 0 CA-C-O 121.561 0.696 . . . . 0.0 110.395 179.678 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.636 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 2.4 ptpt -42.46 -59.55 1.83 Allowed 'General case' 0 C--N 1.296 -1.756 0 O-C-N 121.549 -0.72 . . . . 0.0 111.96 -178.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.659 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 2.6 p90 -86.25 -28.01 24.07 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.471 -1.393 . . . . 0.0 110.391 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.659 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 1.6 mmtp -55.16 -44.44 75.17 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 120.928 -1.107 . . . . 0.0 108.803 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.441 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -65.57 -55.07 19.67 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 122.308 1.051 . . . . 0.0 110.014 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -61.01 -54.13 48.65 Favored 'General case' 0 C--N 1.287 -2.143 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.231 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.496 HD23 ' HA ' ' A' ' 54' ' ' LEU . 44.9 mt -51.6 -29.4 17.27 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.816 -1.177 . . . . 0.0 110.26 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.884 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.335 0.3 OUTLIER -76.06 -57.67 5.77 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 CA-C-O 121.63 0.728 . . . . 0.0 109.857 179.58 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.704 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 105.65 50.57 0.9 Allowed Glycine 0 C--N 1.302 -1.324 0 N-CA-C 110.241 -1.143 . . . . 0.0 110.241 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.884 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.263 1.4 pt -76.93 -120.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.289 -2.064 0 CA-C-O 122.637 1.208 . . . . 0.0 110.127 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.535 ' H ' HD12 ' A' ' 57' ' ' ILE . 3.1 t70 . . . . . 0 C--N 1.259 -3.337 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.11 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.433 ' O ' ' N ' ' A' ' 26' ' ' LYS . 2.0 t . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.246 0.546 . . . . 0.0 110.188 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -51.45 92.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.877 . . . . 0.0 110.604 -179.798 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -57.35 -155.86 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.223 -0.923 . . . . 0.0 110.141 179.76 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.497 ' HG3' ' HB2' ' A' ' 29' ' ' LYS . 0.6 OUTLIER 177.28 88.46 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.23 -0.919 . . . . 0.0 110.485 179.45 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.54 ' HD3' ' N ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -67.67 -12.65 60.96 Favored 'General case' 0 C--N 1.306 -1.315 0 O-C-N 121.256 -0.902 . . . . 0.0 110.94 -179.858 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.497 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 16.3 mttt -44.22 110.95 0.25 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.09 -1.006 . . . . 0.0 110.459 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 31' ' ' GLY . 6.5 mttp -53.99 -167.83 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.367 -0.833 . . . . 0.0 110.477 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -53.28 -167.3 0.02 OUTLIER Glycine 0 N--CA 1.485 1.935 0 N-CA-C 110.244 -1.143 . . . . 0.0 110.244 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -66.82 155.02 72.51 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 O-C-N 124.106 1.582 . . . . 0.0 111.036 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.92 7.46 34.37 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 123.01 1.386 . . . . 0.0 110.368 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.531 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.256 0.2 OUTLIER -69.7 159.97 32.52 Favored 'General case' 0 C--N 1.266 -3.062 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.191 179.641 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.704 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -167.88 -28.64 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 O-C-N 120.922 -1.111 . . . . 0.0 111.803 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 8.9 t70 -94.78 -70.25 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.063 -1.023 . . . . 0.0 109.97 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -63.52 -14.47 51.44 Favored 'General case' 0 C--N 1.283 -2.301 0 CA-C-O 122.041 0.924 . . . . 0.0 109.091 178.719 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.704 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -82.04 -18.15 44.24 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.088 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -46.16 -57.11 4.8 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.353 -0.842 . . . . 0.0 109.46 179.074 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.641 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -61.13 -37.93 84.57 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.565 -0.709 . . . . 0.0 109.876 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.72 -35.48 1.85 Allowed 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.053 -1.029 . . . . 0.0 108.746 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 43' ' ' PHE . 24.7 mtp180 -91.71 -17.62 25.18 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 121.822 -0.549 . . . . 0.0 112.079 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.659 ' O ' HG12 ' A' ' 48' ' ' VAL . 0.8 OUTLIER -40.12 -61.67 0.85 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.156 -0.965 . . . . 0.0 111.027 -178.465 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.1 mptm? -77.48 13.77 1.15 Allowed 'General case' 0 C--N 1.309 -1.168 0 O-C-N 121.143 -0.973 . . . . 0.0 112.498 -179.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.468 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -91.94 -100.54 1.34 Allowed Glycine 0 C--N 1.287 -2.167 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.51 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -106.9 62.71 0.63 Allowed 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.794 -0.827 . . . . 0.0 109.733 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.545 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -145.58 -83.02 0.05 OUTLIER Glycine 0 N--CA 1.485 1.937 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.659 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.2 OUTLIER -50.92 -46.1 29.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 121.985 -0.714 . . . . 0.0 110.848 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HD2' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -42.15 -59.21 1.85 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.525 -0.734 . . . . 0.0 111.947 -177.897 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.691 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.1 p90 -91.26 -27.61 18.32 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 120.363 -1.46 . . . . 0.0 111.019 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.691 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -46.59 -56.82 5.46 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.664 -1.272 . . . . 0.0 109.67 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.521 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -52.75 -54.24 36.7 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-O 122.399 1.095 . . . . 0.0 110.66 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.4 mttm -65.78 -52.55 49.92 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.92 -178.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.599 HD12 ' CD1' ' A' ' 50' ' ' TYR . 30.4 mt -50.87 -22.88 2.42 Favored 'General case' 0 C--N 1.308 -1.214 0 O-C-N 120.709 -1.245 . . . . 0.0 110.792 -179.373 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.785 HG22 HG23 ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -75.31 -57.88 5.58 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.885 0 CA-C-O 121.539 0.685 . . . . 0.0 109.535 179.642 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.684 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 124.27 43.6 0.32 Allowed Glycine 0 N--CA 1.475 1.25 0 C-N-CA 120.077 -1.059 . . . . 0.0 110.864 179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.785 HG23 HG22 ' A' ' 55' ' ' ILE 0.268 1.7 pt -83.88 -123.68 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.235 0 CA-C-O 122.676 1.227 . . . . 0.0 109.944 179.361 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.488 ' H ' HD12 ' A' ' 57' ' ' ILE . 6.3 t0 . . . . . 0 C--N 1.261 -3.274 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.447 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.349 0.595 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -44.46 116.9 1.13 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.404 -0.81 . . . . 0.0 110.724 -179.664 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.471 ' O ' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -68.85 59.16 0.09 Allowed 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.263 -0.898 . . . . 0.0 110.497 179.934 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.477 ' O ' ' N ' ' A' ' 29' ' ' LYS . 4.1 tp10 56.15 157.2 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.345 -0.847 . . . . 0.0 110.607 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -47.84 91.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.301 -0.874 . . . . 0.0 110.737 -179.752 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 27' ' ' GLU . 2.8 ttmt -44.47 138.56 3.17 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.112 -0.993 . . . . 0.0 109.998 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.408 ' O ' ' O ' ' A' ' 31' ' ' GLY . 14.0 mtmt -49.54 165.12 0.07 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.231 -0.918 . . . . 0.0 110.731 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.408 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 45.9 -169.39 0.03 OUTLIER Glycine 0 N--CA 1.488 2.137 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.9 163.22 36.44 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.165 1.613 . . . . 0.0 110.859 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.441 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -94.03 6.88 47.11 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 122.918 1.342 . . . . 0.0 110.532 -179.562 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.557 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.252 0.0 OUTLIER -75.96 142.89 41.86 Favored 'General case' 0 C--N 1.264 -3.149 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.588 179.918 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.618 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -169.05 -25.32 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.267 -0.896 . . . . 0.0 111.618 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.05 -70.38 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.98 -1.075 . . . . 0.0 109.419 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.428 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -65.47 -13.56 59.06 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.038 0.923 . . . . 0.0 108.545 178.118 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.633 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.12 -19.9 56.36 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.131 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -50.87 -56.53 11.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.28 -0.887 . . . . 0.0 109.357 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.762 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -61.73 -35.17 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.116 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.14 -36.9 1.84 Allowed 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.054 -1.029 . . . . 0.0 109.009 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.4 mtp180 -90.69 -19.57 23.45 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.627 -0.67 . . . . 0.0 111.806 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.762 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -42.24 -48.88 5.0 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.142 -0.974 . . . . 0.0 110.627 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.2 mptp? -73.62 13.42 0.48 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.17 -0.957 . . . . 0.0 112.822 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.89 -12.77 48.87 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.547 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -86.4 49.15 1.74 Allowed 'General case' 0 C--N 1.287 -2.122 0 O-C-N 121.766 -0.844 . . . . 0.0 110.116 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -112.8 -73.8 0.65 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.498 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -51.74 -40.28 26.41 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.938 0 CA-C-O 121.628 0.727 . . . . 0.0 110.625 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.496 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 3.2 ptpt -41.04 -59.55 1.44 Allowed 'General case' 0 C--N 1.295 -1.795 0 O-C-N 121.728 -0.607 . . . . 0.0 112.128 -177.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.653 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 3.4 p90 -92.5 -28.38 16.84 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 120.338 -1.476 . . . . 0.0 111.125 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.653 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -58.79 -40.66 84.66 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 120.603 -1.311 . . . . 0.0 109.42 179.589 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.475 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -71.48 -54.71 9.7 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-O 122.395 1.093 . . . . 0.0 110.332 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.6 mttt -60.96 -53.13 61.01 Favored 'General case' 0 C--N 1.285 -2.238 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.877 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 52.7 mt -51.14 -28.24 10.45 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.94 -1.1 . . . . 0.0 110.567 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.89 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.332 0.3 OUTLIER -75.9 -57.19 6.6 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.843 0 CA-C-O 121.629 0.728 . . . . 0.0 109.895 179.771 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.684 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 101.89 51.85 1.06 Allowed Glycine 0 C--N 1.302 -1.323 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.89 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.259 4.4 pt -74.06 -120.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.208 0 CA-C-O 122.654 1.216 . . . . 0.0 110.316 179.838 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 58' ' ' ASP . 46.6 t0 . . . . . 0 C--N 1.259 -3.327 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.395 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.409 ' O ' ' C ' ' A' ' 25' ' ' LYS . 75.4 m . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 121.292 0.568 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.409 ' C ' ' O ' ' A' ' 24' ' ' SER . 31.1 mtpt -42.79 152.16 0.11 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 0.0 110.468 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.402 ' O ' ' HG2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -54.78 135.94 46.92 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.0 110.91 -179.703 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.79 108.09 0.32 Allowed 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.3 -0.875 . . . . 0.0 110.556 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.97 96.85 0.15 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.117 -0.989 . . . . 0.0 110.474 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 tttt -47.14 151.4 0.68 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.259 -0.901 . . . . 0.0 110.596 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.458 ' O ' ' O ' ' A' ' 31' ' ' GLY . 16.0 mttp -75.62 99.59 4.35 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.248 -0.907 . . . . 0.0 110.506 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -43.6 167.09 0.02 OUTLIER Glycine 0 N--CA 1.487 2.034 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -71.04 146.53 52.54 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 O-C-N 124.232 1.648 . . . . 0.0 110.927 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.543 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -98.81 7.52 45.97 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 123.166 1.46 . . . . 0.0 110.201 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.568 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 1.7 mmtp -69.37 153.6 43.33 Favored 'General case' 0 C--N 1.265 -3.086 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.596 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.668 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -165.66 -24.65 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.139 -0.976 . . . . 0.0 112.113 179.719 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 23.3 t0 -101.37 -69.76 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.717 -1.239 . . . . 0.0 109.276 179.161 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.2 -14.88 54.13 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 178.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.698 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.17 -19.54 50.68 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.654 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.69 -56.41 4.45 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.158 -0.964 . . . . 0.0 109.424 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.778 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.6 mm? -59.33 -32.39 70.05 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.848 0.832 . . . . 0.0 109.456 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.698 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -57.61 -41.48 81.37 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.497 ' O ' ' N ' ' A' ' 44' ' ' LYS . 16.3 mmt180 -90.18 -16.7 28.96 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.435 0.636 . . . . 0.0 111.205 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.778 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -39.77 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.474 -0.766 . . . . 0.0 111.318 -179.033 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.597 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.7 OUTLIER -74.1 12.83 0.64 Allowed 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.85 -1.156 . . . . 0.0 112.378 -179.198 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.519 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -42.65 -69.87 0.56 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.5 59.87 0.06 Allowed 'General case' 0 C--N 1.288 -2.085 0 CA-C-O 121.86 0.838 . . . . 0.0 109.422 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 45' ' ' GLY . . . -140.23 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.316 -1.514 . . . . 0.0 109.316 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.475 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -62.99 -44.12 99.48 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.771 0 O-C-N 121.943 -0.74 . . . . 0.0 111.592 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -40.65 -58.87 1.51 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.208 -0.932 . . . . 0.0 111.966 -177.616 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.656 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 4.6 p90 -83.09 -28.15 29.71 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.385 -1.447 . . . . 0.0 110.77 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.656 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -61.07 -42.08 97.82 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.505 -1.372 . . . . 0.0 108.756 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.495 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -71.5 -54.99 8.75 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-O 122.414 1.102 . . . . 0.0 110.188 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -58.9 -53.71 55.36 Favored 'General case' 0 C--N 1.286 -2.177 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.862 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 58.5 mt -50.29 -30.96 13.04 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 120.837 -1.164 . . . . 0.0 109.786 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 1.038 HG23 HG23 ' A' ' 57' ' ' ILE 0.347 0.3 OUTLIER -75.94 -65.05 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.259 179.131 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.782 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 61.65 41.08 99.53 Favored Glycine 0 N--CA 1.481 1.689 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.038 HG23 HG23 ' A' ' 55' ' ' ILE 0.254 4.8 pt -75.43 -120.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.284 -2.26 0 CA-C-O 122.656 1.217 . . . . 0.0 109.796 178.816 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.405 ' N ' ' CG1' ' A' ' 57' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--N 1.26 -3.292 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.47 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.434 ' O ' ' C ' ' A' ' 25' ' ' LYS . 9.7 t . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.104 0.478 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -41.96 150.49 0.12 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 25' ' ' LYS . 34.5 ttmt 179.48 -49.8 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.358 -0.839 . . . . 0.0 110.035 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.5 ' O ' ' N ' ' A' ' 29' ' ' LYS . 31.0 tt0 40.53 86.27 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.509 -0.745 . . . . 0.0 110.286 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 30' ' ' LYS . 3.0 ttpm? 33.45 -92.62 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.876 -0.515 . . . . 0.0 111.162 179.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -49.04 91.7 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.883 -1.136 . . . . 0.0 110.601 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.535 ' O ' ' CG ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -59.78 103.16 0.19 Allowed 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.255 -0.903 . . . . 0.0 111.4 -179.609 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 40.21 -163.63 0.01 OUTLIER Glycine 0 N--CA 1.491 2.342 0 N-CA-C 110.704 -0.958 . . . . 0.0 110.704 179.096 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.55 -169.02 0.2 Allowed 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.324 1.697 . . . . 0.0 111.214 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.51 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -87.24 4.53 42.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-O 123.161 1.457 . . . . 0.0 110.526 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.264 0.1 OUTLIER -70.13 160.7 31.57 Favored 'General case' 0 C--N 1.264 -3.142 0 CA-C-N 113.975 -1.466 . . . . 0.0 110.424 179.53 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.634 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.28 -22.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.645 -1.284 . . . . 0.0 112.63 179.725 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.0 -70.3 0.77 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.685 -1.26 . . . . 0.0 109.606 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -14.54 49.79 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.076 0.941 . . . . 0.0 108.647 178.138 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.736 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.18 -19.0 52.0 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.677 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.615 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.83 -56.44 6.28 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.112 -0.992 . . . . 0.0 109.704 179.675 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.77 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -63.41 -23.64 67.49 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.824 0.821 . . . . 0.0 109.885 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.736 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -56.78 -40.84 76.61 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.041 -1.037 . . . . 0.0 108.844 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.7 mmt-85 -89.84 -17.41 28.16 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.687 -0.633 . . . . 0.0 111.505 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.77 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -39.47 -36.93 0.42 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.399 -0.813 . . . . 0.0 110.735 -179.297 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 2.7 mptt -76.09 13.8 0.82 Allowed 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.171 -0.956 . . . . 0.0 112.638 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -127.85 -72.86 0.17 Allowed Glycine 0 N--CA 1.49 2.268 0 C-N-CA 120.115 -1.041 . . . . 0.0 110.526 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.629 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -75.71 39.56 0.17 Allowed 'General case' 0 C--N 1.289 -2.045 0 O-C-N 121.879 -0.777 . . . . 0.0 111.342 -178.94 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -98.68 -62.03 0.86 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.453 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -51.17 -43.73 28.11 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 CA-C-O 121.613 0.721 . . . . 0.0 110.51 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.629 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 2.8 ptpt -42.18 -59.8 1.67 Allowed 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.516 -0.74 . . . . 0.0 112.182 -178.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.73 ' HD1' HD12 ' A' ' 54' ' ' LEU . 3.9 p90 -90.12 -27.53 19.56 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.472 -1.392 . . . . 0.0 110.585 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.658 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -48.59 -52.78 21.19 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 120.777 -1.202 . . . . 0.0 109.21 179.483 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.52 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -60.11 -53.67 55.05 Favored 'General case' 0 C--N 1.285 -2.224 0 CA-C-O 122.467 1.127 . . . . 0.0 110.396 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -62.93 -52.58 62.51 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.722 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.73 HD12 ' HD1' ' A' ' 50' ' ' TYR . 40.8 mt -51.38 -24.67 5.03 Favored 'General case' 0 C--N 1.306 -1.319 0 O-C-N 120.787 -1.196 . . . . 0.0 110.833 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.696 HG22 ' N ' ' A' ' 56' ' ' GLY 0.329 0.3 OUTLIER -75.37 -56.73 7.87 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 CA-C-O 121.604 0.716 . . . . 0.0 109.832 179.537 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.696 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 122.2 46.55 0.3 Allowed Glycine 0 C--N 1.302 -1.332 0 N-CA-C 110.285 -1.126 . . . . 0.0 110.285 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.645 HG23 HG22 ' A' ' 55' ' ' ILE 0.261 1.3 pt -76.73 -119.82 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.159 0 CA-C-O 122.571 1.177 . . . . 0.0 110.424 179.876 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.576 ' H ' HD12 ' A' ' 57' ' ' ILE . 33.3 t70 . . . . . 0 C--N 1.26 -3.291 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.41 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 121.308 0.575 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -59.98 -11.08 4.94 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.366 -0.834 . . . . 0.0 110.654 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.48 145.6 14.64 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.109 -0.994 . . . . 0.0 110.426 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -45.65 -25.46 0.47 Allowed 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.304 -0.872 . . . . 0.0 110.688 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.499 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -55.41 -17.21 4.58 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.207 -0.933 . . . . 0.0 110.798 -179.552 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.499 ' C ' ' O ' ' A' ' 28' ' ' LYS . 0.5 OUTLIER 27.58 68.22 0.07 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 121.378 0.609 . . . . 0.0 111.41 179.554 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.464 ' O ' ' O ' ' A' ' 31' ' ' GLY . 7.7 mmtp -53.83 129.52 33.91 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.281 -0.887 . . . . 0.0 110.803 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 46.08 -175.29 0.01 OUTLIER Glycine 0 N--CA 1.487 2.042 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.5 Cg_endo -68.34 -166.05 0.14 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 124.249 1.657 . . . . 0.0 111.688 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.443 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.74 5.39 32.5 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 123.027 1.394 . . . . 0.0 110.879 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.619 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.261 0.0 OUTLIER -66.43 164.52 16.13 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 114.055 -1.43 . . . . 0.0 110.655 179.912 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.656 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 1.3 m -166.16 -22.12 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.938 -1.102 . . . . 0.0 112.733 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -103.22 -70.65 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.552 -1.343 . . . . 0.0 109.81 179.443 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.472 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 19.7 mt-10 -63.5 -15.11 56.92 Favored 'General case' 0 C--N 1.284 -2.276 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.776 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.73 -19.11 55.75 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.306 -179.944 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.591 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -44.33 -55.67 4.77 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.779 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.826 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.6 mm? -60.53 -26.67 67.05 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.85 0.833 . . . . 0.0 109.384 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -58.7 -41.03 85.35 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.05 -1.031 . . . . 0.0 108.224 178.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 44' ' ' LYS . 7.2 mmm-85 -89.73 -16.22 30.81 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.393 0.616 . . . . 0.0 110.82 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.826 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -42.04 -25.08 0.06 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.382 -0.824 . . . . 0.0 110.337 -179.644 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.611 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.6 mptp? -72.45 12.97 0.39 Allowed 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.217 -0.927 . . . . 0.0 112.871 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -89.65 -101.63 1.09 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 108.663 -1.775 . . . . 0.0 108.663 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.643 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -85.91 33.77 0.6 Allowed 'General case' 0 C--N 1.296 -1.721 0 O-C-N 121.554 -0.968 . . . . 0.0 109.938 179.394 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.476 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -97.72 -64.93 0.89 Allowed Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.448 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -49.21 -43.42 16.2 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 CA-C-O 121.429 0.633 . . . . 0.0 110.477 179.877 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.583 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -42.11 -59.64 1.7 Allowed 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.446 -0.784 . . . . 0.0 111.676 -178.08 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.652 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 3.1 p90 -88.97 -26.47 21.48 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.43 -1.419 . . . . 0.0 110.489 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.652 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -53.97 -42.6 69.12 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 120.932 -1.105 . . . . 0.0 108.975 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.504 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -59.78 -54.28 48.11 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-O 122.431 1.11 . . . . 0.0 109.829 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -68.7 -53.06 24.45 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.534 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.623 HD12 ' CD1' ' A' ' 50' ' ' TYR . 30.3 mt -50.7 -22.5 2.11 Favored 'General case' 0 C--N 1.308 -1.196 0 O-C-N 120.751 -1.218 . . . . 0.0 110.399 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 1.008 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.341 0.3 OUTLIER -75.5 -61.2 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 CA-C-O 121.644 0.735 . . . . 0.0 109.222 179.265 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.749 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 73.95 50.29 11.25 Favored Glycine 0 N--CA 1.483 1.806 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.181 177.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.008 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.253 3.1 pt -72.43 -117.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.151 0 CA-C-O 122.597 1.189 . . . . 0.0 109.978 178.394 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 t70 . . . . . 0 C--N 1.26 -3.291 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.155 179.682 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.478 ' O ' ' N ' ' A' ' 26' ' ' LYS . 39.7 t . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.247 0.546 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' A' ' 26' ' ' LYS . 5.2 mtmp? -66.44 59.13 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.385 -0.822 . . . . 0.0 110.547 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.518 ' O ' ' N ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -54.6 -164.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.259 -0.901 . . . . 0.0 110.338 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.44 ' O ' ' C ' ' A' ' 28' ' ' LYS . 2.0 tt0 45.66 -91.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.341 -0.849 . . . . 0.0 110.154 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.546 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -41.29 119.4 1.2 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.282 -0.886 . . . . 0.0 109.865 179.768 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.546 ' C ' ' O ' ' A' ' 28' ' ' LYS . 4.9 ttmt -15.92 83.34 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 121.481 0.657 . . . . 0.0 111.938 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -51.07 130.09 25.23 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.396 -0.815 . . . . 0.0 110.945 -179.445 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.461 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 40.59 -162.77 0.01 OUTLIER Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.4 169.0 18.0 Favored 'Trans proline' 0 C--N 1.302 -1.884 0 O-C-N 124.187 1.625 . . . . 0.0 110.939 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.83 8.84 37.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 123.16 1.457 . . . . 0.0 110.235 -179.548 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.478 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.257 0.0 OUTLIER -62.01 157.64 18.27 Favored 'General case' 0 C--N 1.268 -2.958 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.26 179.532 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.666 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.1 -23.73 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.748 -1.22 . . . . 0.0 112.716 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t0 -101.5 -70.33 0.75 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.717 -1.239 . . . . 0.0 109.881 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.13 -14.74 52.17 Favored 'General case' 0 C--N 1.282 -2.348 0 CA-C-O 122.031 0.92 . . . . 0.0 108.572 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.691 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.85 -19.16 49.0 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.482 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -44.09 -56.2 4.2 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.881 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.5 mm? -64.91 -32.02 73.53 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.651 -0.656 . . . . 0.0 110.076 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -42.98 -33.1 0.74 Allowed 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.045 -1.034 . . . . 0.0 109.085 178.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -90.71 -17.35 26.91 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.346 0.594 . . . . 0.0 111.427 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.881 ' CD2' HD13 ' A' ' 40' ' ' LEU . 2.8 m-85 -55.49 -11.98 1.01 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.312 -0.868 . . . . 0.0 111.241 -179.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.596 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.8 mptt -70.53 13.54 0.17 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.049 -1.032 . . . . 0.0 113.207 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.84 -90.21 0.02 OUTLIER Glycine 0 N--CA 1.488 2.119 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.609 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 1.6 m-20 -85.67 30.02 0.67 Allowed 'General case' 0 C--N 1.293 -1.883 0 O-C-N 121.874 -0.78 . . . . 0.0 110.521 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.561 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -88.28 -54.53 2.4 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.467 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -49.48 -46.17 19.88 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.245 0 CA-C-O 121.373 0.606 . . . . 0.0 110.381 179.66 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.533 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 0.1 OUTLIER -44.48 -59.43 2.44 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.419 -0.8 . . . . 0.0 111.804 -178.128 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.656 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.0 p90 -90.22 -28.65 18.72 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 120.542 -1.349 . . . . 0.0 111.649 -179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.656 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 2.1 mmtm -53.44 -45.79 69.6 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 120.533 -1.354 . . . . 0.0 109.279 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.462 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -66.59 -55.07 17.07 Favored 'General case' 0 C--N 1.287 -2.141 0 CA-C-O 122.307 1.051 . . . . 0.0 109.841 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.407 ' HB2' ' HA ' ' A' ' 50' ' ' TYR . 22.1 mttt -56.45 -54.66 43.09 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.533 -179.578 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 39.5 mt -51.49 -30.05 18.71 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 120.811 -1.181 . . . . 0.0 109.773 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 1.001 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.344 0.3 OUTLIER -81.37 -62.84 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.993 179.848 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.756 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 72.31 50.02 18.19 Favored Glycine 0 N--CA 1.481 1.654 0 O-C-N 121.529 -0.732 . . . . 0.0 111.986 178.436 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.001 HG23 ' CG2' ' A' ' 55' ' ' ILE . 4.2 pt -72.38 -117.73 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 CA-C-O 122.661 1.219 . . . . 0.0 109.932 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.409 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 16.1 t0 . . . . . 0 C--N 1.26 -3.307 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.066 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 121.164 0.507 . . . . 0.0 110.135 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 24' ' ' SER . 5.7 tttp -177.09 93.42 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.289 -0.882 . . . . 0.0 110.354 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.442 ' O ' ' N ' ' A' ' 28' ' ' LYS . 2.7 tttt 54.47 67.47 1.01 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.478 -0.764 . . . . 0.0 110.558 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 26' ' ' LYS . 2.9 tt0 -42.0 -26.62 0.1 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.277 -0.889 . . . . 0.0 110.253 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 29' ' ' LYS . 6.6 tptt -56.79 -14.2 3.19 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.182 -0.949 . . . . 0.0 110.547 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -48.16 -177.98 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.368 -0.832 . . . . 0.0 110.613 -179.63 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.461 ' O ' ' O ' ' A' ' 31' ' ' GLY . 3.5 mttm -39.38 100.73 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.381 -0.824 . . . . 0.0 110.671 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.461 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 52.57 170.2 0.02 OUTLIER Glycine 0 N--CA 1.486 1.971 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -70.47 176.13 7.74 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 124.136 1.598 . . . . 0.0 110.928 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.45 ' O ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.6 8.91 31.83 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.214 1.483 . . . . 0.0 110.047 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.63 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.268 0.4 OUTLIER -70.66 -178.81 1.93 Allowed 'General case' 0 C--N 1.266 -3.022 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.772 179.784 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.661 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.63 -18.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.774 -1.204 . . . . 0.0 113.574 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.495 ' HA ' HD23 ' A' ' 39' ' ' LEU . 32.5 t70 -106.67 -70.97 0.77 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.384 -1.447 . . . . 0.0 110.506 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.506 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 6.4 mt-10 -63.25 -14.25 47.33 Favored 'General case' 0 C--N 1.283 -2.299 0 CA-C-O 122.25 1.024 . . . . 0.0 108.388 178.092 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.661 ' CE1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.37 -18.51 52.24 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.405 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.35 -57.0 3.77 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.169 179.725 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.68 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.1 mm? -61.46 -37.49 83.77 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.554 -0.716 . . . . 0.0 109.508 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.41 -33.05 5.56 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.677 -1.265 . . . . 0.0 108.006 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.403 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -90.79 -20.19 22.63 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.916 -0.49 . . . . 0.0 111.347 179.79 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.68 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -43.18 -45.86 5.75 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.22 -0.925 . . . . 0.0 109.728 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.646 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 8.4 mptt -78.53 13.13 1.7 Allowed 'General case' 0 C--N 1.308 -1.237 0 O-C-N 121.333 -0.854 . . . . 0.0 111.83 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.509 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -74.2 -91.35 0.15 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.401 ' HA ' ' CD ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -99.42 61.94 1.21 Allowed 'General case' 0 C--N 1.295 -1.767 0 O-C-N 121.695 -0.885 . . . . 0.0 109.705 -179.864 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.489 ' HA2' ' OH ' ' A' ' 50' ' ' TYR . . . -139.8 -72.31 0.04 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.669 -1.773 . . . . 0.0 108.669 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -45.4 98.95 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.896 0 CA-C-O 121.386 0.612 . . . . 0.0 111.982 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.2 OUTLIER -42.21 -60.29 1.51 Allowed 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.28 -0.887 . . . . 0.0 112.612 -177.078 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.679 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 10.5 p90 -82.93 -33.45 26.8 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.184 -1.573 . . . . 0.0 111.208 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.679 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -49.16 -56.63 8.6 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.683 -1.261 . . . . 0.0 109.252 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.473 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -50.18 -54.66 19.31 Favored 'General case' 0 C--N 1.284 -2.255 0 CA-C-O 122.336 1.065 . . . . 0.0 110.56 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -67.08 -53.66 28.79 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.496 -178.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 33.0 mt -51.15 -24.03 3.8 Favored 'General case' 0 C--N 1.307 -1.255 0 O-C-N 120.768 -1.208 . . . . 0.0 110.437 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 1.064 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.336 0.3 OUTLIER -75.51 -58.72 4.12 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.783 0 CA-C-O 121.633 0.73 . . . . 0.0 109.512 179.627 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.717 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 87.24 51.3 3.37 Favored Glycine 0 N--CA 1.48 1.614 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.806 178.27 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.064 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.255 4.0 pt -73.75 -119.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.157 0 CA-C-O 122.743 1.259 . . . . 0.0 109.964 178.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.3 t0 . . . . . 0 C--N 1.261 -3.247 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.401 -179.795 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.217 0.532 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.5 -24.95 0.95 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.307 -0.871 . . . . 0.0 110.377 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.444 ' O ' ' HB3' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -47.08 -76.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.272 -0.893 . . . . 0.0 110.521 -179.868 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.444 ' HB3' ' O ' ' A' ' 26' ' ' LYS . 3.2 tp10 61.22 117.55 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.318 -0.864 . . . . 0.0 110.036 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -44.2 110.36 0.21 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.34 -0.85 . . . . 0.0 110.749 -179.835 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.62 78.3 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.406 -0.809 . . . . 0.0 110.556 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 28' ' ' LYS . 12.0 ptmm? -48.42 132.81 16.66 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.168 -0.957 . . . . 0.0 110.967 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.443 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -46.33 172.01 0.02 OUTLIER Glycine 0 N--CA 1.487 2.048 0 N-CA-C 109.9 -1.28 . . . . 0.0 109.9 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.21 149.55 64.2 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 O-C-N 123.984 1.518 . . . . 0.0 111.11 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -99.36 10.29 41.68 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 123.271 1.51 . . . . 0.0 109.843 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.594 ' CD ' ' HB2' ' A' ' 38' ' ' TYR 0.266 0.1 OUTLIER -81.64 91.25 6.39 Favored 'General case' 0 C--N 1.267 -3.017 0 CA-C-N 113.798 -1.546 . . . . 0.0 110.177 179.824 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.641 ' CA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -154.5 -30.72 0.11 Allowed 'General case' 0 C--N 1.291 -1.96 0 O-C-N 121.642 -0.661 . . . . 0.0 110.569 -179.792 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 2.9 t0 -107.19 -68.72 0.88 Allowed 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -13.39 59.91 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.654 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -80.33 -19.89 45.49 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.202 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.58 -56.53 5.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.166 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.88 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.1 mm? -60.78 -35.58 76.8 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.739 0.78 . . . . 0.0 109.839 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -46.85 -38.97 11.14 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 120.847 -1.158 . . . . 0.0 108.555 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -90.82 -17.46 26.55 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.715 -0.616 . . . . 0.0 111.722 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.88 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.3 m-85 -44.66 -40.01 5.53 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 110.977 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.6 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -68.76 14.55 0.07 Allowed 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.47 -103.35 2.84 Favored Glycine 0 C--N 1.288 -2.137 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.024 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.42 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -107.91 65.73 0.64 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.904 0.859 . . . . 0.0 109.956 -179.358 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.546 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -142.68 -75.84 0.04 OUTLIER Glycine 0 N--CA 1.485 1.905 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 179.489 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.634 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.3 OUTLIER -56.82 -46.59 83.47 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 CA-C-O 121.398 0.618 . . . . 0.0 111.283 179.834 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.563 ' HE3' ' N ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -41.85 -59.94 1.54 Allowed 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.36 -0.838 . . . . 0.0 112.032 -177.669 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.678 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.4 p90 -87.51 -27.83 22.4 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.261 -1.524 . . . . 0.0 111.362 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.678 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -52.2 -52.47 52.0 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.589 -1.32 . . . . 0.0 109.054 179.793 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.493 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -54.41 -54.01 46.37 Favored 'General case' 0 C--N 1.285 -2.237 0 CA-C-O 122.413 1.102 . . . . 0.0 110.422 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -66.1 -53.85 32.92 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.817 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 31.5 mt -51.15 -23.31 3.16 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 120.755 -1.216 . . . . 0.0 110.606 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.845 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -75.76 -57.46 6.19 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.91 0 CA-C-O 121.604 0.716 . . . . 0.0 110.056 179.778 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.705 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 113.93 46.22 0.66 Allowed Glycine 0 C--N 1.301 -1.379 0 N-CA-C 110.081 -1.208 . . . . 0.0 110.081 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.845 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.26 3.1 pt -76.3 -120.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.22 0 CA-C-O 122.648 1.213 . . . . 0.0 110.262 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 57' ' ' ILE . 26.2 t0 . . . . . 0 C--N 1.26 -3.288 0 CA-C-N 114.583 -1.19 . . . . 0.0 110.182 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.15 0.5 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 0.4 OUTLIER 174.84 176.16 0.17 Allowed 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.049 -1.032 . . . . 0.0 110.017 179.77 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.478 ' O ' ' HG2' ' A' ' 26' ' ' LYS . 38.9 tttt -178.12 42.6 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.3 -0.875 . . . . 0.0 110.024 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.493 ' O ' ' O ' ' A' ' 28' ' ' LYS . 21.4 pt-20 -45.17 -22.64 0.12 Allowed 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.272 -0.893 . . . . 0.0 110.58 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 27' ' ' GLU . 20.2 ptmt -53.09 -162.63 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.345 -0.847 . . . . 0.0 111.104 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 28' ' ' LYS . 2.2 ttpt -39.34 126.28 1.74 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.401 -0.812 . . . . 0.0 111.078 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' A' ' 31' ' ' GLY . 5.9 mttp -66.58 -174.44 0.3 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.313 -0.867 . . . . 0.0 110.364 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.463 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -54.11 -168.4 0.03 OUTLIER Glycine 0 N--CA 1.483 1.774 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.502 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.3 Cg_endo -67.47 -169.39 0.21 Allowed 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.108 1.583 . . . . 0.0 111.28 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.524 ' O ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -93.88 12.87 24.44 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 123.279 1.514 . . . . 0.0 110.088 -179.557 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.563 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.26 0.1 OUTLIER -60.67 157.19 15.1 Favored 'General case' 0 C--N 1.265 -3.07 0 CA-C-N 113.957 -1.474 . . . . 0.0 110.641 179.473 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.672 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -165.5 -27.04 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.928 -1.108 . . . . 0.0 111.797 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.4 OUTLIER -97.33 -70.85 0.7 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.915 -1.115 . . . . 0.0 109.774 179.488 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -63.55 -14.65 53.32 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 122.005 0.907 . . . . 0.0 108.667 178.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.765 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -78.58 -19.79 51.99 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.266 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -45.62 -56.04 5.65 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.214 -0.929 . . . . 0.0 108.994 178.619 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.96 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -62.37 -24.83 67.58 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 121.844 0.831 . . . . 0.0 109.758 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -55.22 -44.76 75.73 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.085 -1.009 . . . . 0.0 108.567 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.433 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.1 OUTLIER -89.49 -17.78 27.99 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.382 0.61 . . . . 0.0 110.998 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.96 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -41.05 -44.31 2.39 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.419 -0.8 . . . . 0.0 110.335 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.619 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 12.0 mptt -73.0 14.37 0.29 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.043 -1.036 . . . . 0.0 113.151 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.482 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -156.46 -99.24 0.16 Allowed Glycine 0 N--CA 1.489 2.225 0 C-N-CA 119.491 -1.337 . . . . 0.0 111.702 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.521 ' HA ' ' CD ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -92.45 58.85 3.27 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.677 -0.896 . . . . 0.0 110.252 -178.575 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.526 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -130.73 -67.35 0.1 OUTLIER Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.202 -1.959 . . . . 0.0 108.202 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -67.36 -44.19 87.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.521 ' CD ' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -41.51 -58.8 1.79 Allowed 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.269 -0.894 . . . . 0.0 113.214 -176.74 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.673 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 18.3 p90 -89.3 -37.8 14.66 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.291 -1.505 . . . . 0.0 112.327 -178.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.673 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -49.17 -53.53 20.7 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 120.225 -1.547 . . . . 0.0 109.82 -179.831 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.476 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -59.15 -54.08 51.08 Favored 'General case' 0 C--N 1.283 -2.285 0 CA-C-O 122.463 1.125 . . . . 0.0 110.315 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.52 -53.34 56.18 Favored 'General case' 0 C--N 1.284 -2.273 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.397 -178.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 40.1 mt -51.46 -26.58 8.41 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 120.823 -1.173 . . . . 0.0 110.795 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.777 HG22 HG23 ' A' ' 57' ' ' ILE 0.334 0.3 OUTLIER -74.93 -54.88 13.34 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 CA-C-O 121.82 0.819 . . . . 0.0 109.958 179.81 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.692 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 111.51 48.97 0.67 Allowed Glycine 0 C--N 1.299 -1.491 0 N-CA-C 110.048 -1.221 . . . . 0.0 110.048 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.777 HG23 HG22 ' A' ' 55' ' ' ILE 0.266 2.7 pt -76.5 -121.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.168 0 CA-C-O 122.768 1.271 . . . . 0.0 109.899 179.7 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 C--N 1.261 -3.274 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.501 179.946 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo . . . . . 0 N--CA 1.484 0.915 0 CA-C-O 121.187 0.411 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.451 ' CG ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.95 14.67 31.31 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-O 123.021 1.391 . . . . 0.0 110.171 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.577 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.258 0.1 OUTLIER -56.35 159.9 3.35 Favored 'General case' 0 C--N 1.267 -2.993 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.66 179.75 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.698 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -163.5 -19.74 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.954 -1.091 . . . . 0.0 113.142 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -103.09 -70.42 0.76 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.43 -1.419 . . . . 0.0 110.024 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.01 -13.77 60.48 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.18 0.99 . . . . 0.0 108.506 178.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.791 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.9 -20.01 53.67 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.236 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.679 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.54 -55.82 5.81 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.197 -0.939 . . . . 0.0 108.762 178.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.878 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.8 mm? -58.77 -25.89 63.49 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 121.679 0.752 . . . . 0.0 109.489 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.791 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -62.99 -50.57 70.21 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -86.89 -14.53 41.68 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.629 -0.67 . . . . 0.0 110.464 179.688 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.878 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.6 OUTLIER -40.32 -42.36 1.53 Allowed 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 121.38 0.609 . . . . 0.0 110.239 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -75.76 13.63 0.79 Allowed 'General case' 0 C--N 1.307 -1.28 0 O-C-N 121.322 -0.861 . . . . 0.0 112.77 -178.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -131.64 -104.99 1.0 Allowed Glycine 0 C--N 1.288 -2.111 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -91.29 33.04 0.99 Allowed 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.67 -0.9 . . . . 0.0 110.991 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -84.4 -48.55 5.0 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 108.398 -1.881 . . . . 0.0 108.398 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.283 -2.325 0 CA-C-N 114.521 -0.84 . . . . 0.0 111.012 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo . . . . . 0 N--CA 1.483 0.888 0 CA-C-O 121.313 0.464 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -96.28 13.87 26.11 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 123.14 1.447 . . . . 0.0 109.833 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.557 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.255 4.5 mmtp -70.54 157.0 38.67 Favored 'General case' 0 C--N 1.267 -2.978 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.785 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.622 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -167.19 -27.08 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 O-C-N 121.086 -1.009 . . . . 0.0 111.779 179.595 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.519 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.7 t70 -101.64 -69.96 0.76 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.04 -1.037 . . . . 0.0 109.522 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.547 ' CB ' ' HE2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -61.35 -16.13 43.1 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-O 122.077 0.942 . . . . 0.0 108.568 178.234 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.734 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -78.47 -18.98 54.08 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.298 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.597 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.39 -57.12 4.29 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.271 -0.893 . . . . 0.0 109.545 179.284 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.786 HD13 ' CG ' ' A' ' 43' ' ' PHE . 2.2 mm? -61.53 -32.75 72.82 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.549 -0.719 . . . . 0.0 109.717 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.734 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -44.36 -32.47 1.34 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 120.934 -1.104 . . . . 0.0 108.67 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -91.22 -16.91 26.89 Favored 'General case' 0 C--N 1.309 -1.192 0 O-C-N 121.729 -0.607 . . . . 0.0 111.649 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.786 ' CG ' HD13 ' A' ' 40' ' ' LEU . 1.4 m-85 -48.68 -17.61 0.19 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.291 -0.881 . . . . 0.0 111.41 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.8 OUTLIER -68.58 13.45 0.1 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.941 -1.099 . . . . 0.0 113.269 -178.608 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 43' ' ' PHE . . . -89.32 -93.72 1.12 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.432 ' OD1' ' N ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -99.46 60.59 1.15 Allowed 'General case' 0 C--N 1.297 -1.691 0 O-C-N 121.709 -0.877 . . . . 0.0 109.541 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -141.57 -77.48 0.05 OUTLIER Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.136 -1.586 . . . . 0.0 109.136 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.427 ' CG1' ' HA ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.296 -1.745 0 O-C-N 122.103 -0.645 . . . . 0.0 110.903 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.516 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 41.2 Cg_endo . . . . . 0 N--CA 1.483 0.9 0 CA-C-O 121.343 0.476 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.16 10.69 23.51 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.886 1.326 . . . . 0.0 110.537 -179.271 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 38' ' ' TYR 0.258 0.0 OUTLIER -63.33 114.79 4.04 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.035 179.552 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.679 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -140.44 -13.84 1.0 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 118.931 -1.107 . . . . 0.0 112.418 -179.414 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.463 ' HA ' HD23 ' A' ' 39' ' ' LEU . 63.8 t0 -107.1 -70.32 0.8 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.153 -0.967 . . . . 0.0 109.785 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -63.2 -15.78 58.05 Favored 'General case' 0 C--N 1.283 -2.319 0 CA-C-O 122.207 1.004 . . . . 0.0 108.466 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.679 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.97 -18.61 49.9 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.673 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.23 -56.99 4.96 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.156 -0.965 . . . . 0.0 109.588 179.636 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.895 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -61.16 -35.93 78.46 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.471 -0.768 . . . . 0.0 109.59 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.675 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -46.25 -35.36 5.16 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.952 -1.093 . . . . 0.0 108.5 178.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -90.82 -18.34 25.05 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.804 -0.56 . . . . 0.0 111.44 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.895 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.2 m-85 -45.73 -26.62 0.67 Allowed 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.164 -0.96 . . . . 0.0 110.235 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.628 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.6 mptp? -75.67 13.37 0.82 Allowed 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.351 -0.843 . . . . 0.0 112.559 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -86.3 -95.09 0.83 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.11 59.62 2.28 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.751 -0.853 . . . . 0.0 109.56 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -139.31 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.485 1.959 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.428 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.801 0 CA-C-O 121.456 0.646 . . . . 0.0 111.328 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo . . . . . 0 N--CA 1.481 0.788 0 CA-C-O 121.313 0.464 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -95.38 17.0 15.36 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 123.198 1.475 . . . . 0.0 109.473 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.575 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.259 0.1 OUTLIER -50.94 151.62 2.48 Favored 'General case' 0 C--N 1.269 -2.902 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.02 179.966 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.626 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -157.45 -27.0 0.09 Allowed 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.207 -0.933 . . . . 0.0 111.975 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -98.58 -69.79 0.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.921 -1.112 . . . . 0.0 109.579 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HA ' ' OE1' ' A' ' 37' ' ' GLU . 1.9 mm-40 -61.88 -15.04 39.4 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 121.965 0.888 . . . . 0.0 109.056 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.731 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -80.68 -19.28 45.52 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.876 -179.51 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.671 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.9 -56.46 5.41 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 120.99 -1.069 . . . . 0.0 109.343 178.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.773 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -60.33 -34.75 74.27 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.69 0.757 . . . . 0.0 109.734 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.731 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.61 -35.64 1.83 Allowed 'General case' 0 C--N 1.3 -1.551 0 O-C-N 120.902 -1.124 . . . . 0.0 108.746 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -90.76 -19.1 23.88 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.712 -0.617 . . . . 0.0 111.417 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.773 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -46.46 -38.61 9.38 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.206 -0.934 . . . . 0.0 110.32 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.0 OUTLIER -75.19 13.2 0.75 Allowed 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.345 -0.847 . . . . 0.0 112.796 -178.47 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.46 -94.69 0.1 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -76.21 38.33 0.17 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.628 -0.924 . . . . 0.0 111.419 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -88.46 -50.32 3.42 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 108.142 -1.983 . . . . 0.0 108.142 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.287 -2.138 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.079 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo . . . . . 0 N--CA 1.48 0.735 0 N-CA-C 110.756 -0.517 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.46 2.08 53.52 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 123.145 1.45 . . . . 0.0 110.166 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.513 ' HD3' ' HB3' ' A' ' 38' ' ' TYR 0.251 1.3 mmtp -67.91 153.77 43.0 Favored 'General case' 0 C--N 1.264 -3.139 0 CA-C-N 113.997 -1.456 . . . . 0.0 110.046 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.679 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.09 -24.67 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.05 -1.031 . . . . 0.0 112.236 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -70.75 0.71 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.916 -1.115 . . . . 0.0 110.014 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.73 -13.35 54.44 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-O 122.002 0.906 . . . . 0.0 108.765 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.791 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.57 -19.58 49.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.428 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -47.47 -56.64 6.61 Favored 'General case' 0 C--N 1.306 -1.283 0 O-C-N 121.065 -1.022 . . . . 0.0 109.152 178.893 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.612 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 1.8 mm? -58.64 -34.15 70.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.856 0.836 . . . . 0.0 109.219 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.791 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.22 -35.87 8.13 Favored 'General case' 0 C--N 1.297 -1.716 0 O-C-N 120.928 -1.108 . . . . 0.0 108.049 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.462 ' HD3' ' OD1' ' A' ' 46' ' ' ASP . 3.4 mtt180 -90.5 -20.61 22.49 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 121.809 -0.557 . . . . 0.0 111.452 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.612 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.1 m-85 -42.66 -34.83 0.96 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.205 -0.934 . . . . 0.0 109.965 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.5 mptt -77.81 13.29 1.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.416 -0.803 . . . . 0.0 112.224 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -151.54 -96.01 0.13 Allowed Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.462 ' OD1' ' HD3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -84.35 55.78 3.5 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.716 -0.873 . . . . 0.0 109.284 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.417 ' HA3' ' HA ' ' A' ' 43' ' ' PHE . . . -129.88 -77.82 0.19 Allowed Glycine 0 N--CA 1.487 2.099 0 N-CA-C 108.379 -1.889 . . . . 0.0 108.379 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.458 HG12 ' H ' ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.294 -1.825 0 O-C-N 122.003 -0.704 . . . . 0.0 110.499 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.548 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.2 Cg_endo . . . . . 0 N--CA 1.483 0.88 0 CA-C-O 121.409 0.504 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.446 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.6 9.34 16.36 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.908 1.337 . . . . 0.0 111.039 -178.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.563 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.262 0.0 OUTLIER -60.72 161.22 8.17 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.22 179.352 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.658 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -163.79 -26.66 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.724 -1.235 . . . . 0.0 112.402 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -97.17 -70.55 0.71 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.794 -1.191 . . . . 0.0 110.104 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.1 -13.78 50.13 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.968 0.889 . . . . 0.0 109.022 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.781 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.88 -19.52 48.06 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.186 -179.434 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.734 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -49.31 -55.69 11.98 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 120.804 -1.185 . . . . 0.0 108.793 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.663 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -59.19 -25.76 64.23 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.932 0.872 . . . . 0.0 109.341 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.781 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -54.3 -37.58 64.95 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 120.957 -1.09 . . . . 0.0 108.197 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' LYS . 18.3 mmm180 -90.23 -18.33 25.88 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.412 0.625 . . . . 0.0 111.187 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.663 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.1 m-85 -43.33 -23.12 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.311 -0.868 . . . . 0.0 110.799 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.53 12.81 0.56 Allowed 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.108 -0.995 . . . . 0.0 112.441 -178.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -74.0 -84.16 0.31 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 110.089 -1.204 . . . . 0.0 110.089 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.25 59.39 2.61 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.617 0.722 . . . . 0.0 109.484 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -139.83 -76.98 0.05 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.438 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.768 0 O-C-N 122.094 -0.65 . . . . 0.0 110.702 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo . . . . . 0 N--CA 1.482 0.841 0 N-CA-C 110.734 -0.525 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -91.18 7.3 41.36 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 123.234 1.492 . . . . 0.0 110.271 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.546 ' NZ ' ' HB2' ' A' ' 37' ' ' GLU 0.259 0.3 OUTLIER -73.44 138.08 44.96 Favored 'General case' 0 C--N 1.263 -3.166 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.446 179.742 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.625 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -170.76 -25.99 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.257 -0.902 . . . . 0.0 111.403 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -102.79 -69.74 0.78 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.139 -0.976 . . . . 0.0 109.059 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.546 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 4.7 mt-10 -63.13 -15.1 55.66 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.73 -19.52 52.16 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.326 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.585 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -45.64 -56.35 5.3 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.121 -0.987 . . . . 0.0 109.541 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.823 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -62.73 -37.94 88.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.58 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.81 -39.28 8.18 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.823 -1.173 . . . . 0.0 108.792 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.446 ' HD3' ' HB2' ' A' ' 46' ' ' ASP . 8.0 mtt180 -91.0 -17.21 26.66 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.714 -0.616 . . . . 0.0 111.767 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.823 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.5 m-85 -44.16 -42.28 6.3 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.217 -0.927 . . . . 0.0 110.96 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -73.34 12.93 0.5 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.191 -0.943 . . . . 0.0 112.966 -178.58 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -160.27 -96.66 0.11 Allowed Glycine 0 C--N 1.286 -2.217 0 C-N-CA 120.013 -1.089 . . . . 0.0 110.404 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.446 ' HB2' ' HD3' ' A' ' 42' ' ' ARG . 5.9 m-20 -75.55 36.44 0.13 Allowed 'General case' 0 C--N 1.296 -1.735 0 O-C-N 121.617 -0.931 . . . . 0.0 112.011 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -88.57 -50.12 3.45 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.415 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.285 -2.214 0 CA-C-N 114.763 -0.718 . . . . 0.0 110.884 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 N--CA 1.481 0.77 0 N-CA-C 110.848 -0.482 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.97 12.63 33.56 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 123.155 1.455 . . . . 0.0 109.848 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.565 ' CD ' ' HB3' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -61.49 158.39 14.99 Favored 'General case' 0 C--N 1.267 -3.0 0 CA-C-N 113.925 -1.489 . . . . 0.0 110.52 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.626 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.53 -24.92 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 O-C-N 121.028 -1.045 . . . . 0.0 112.395 179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.454 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 m-20 -100.2 -70.41 0.74 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.814 -1.179 . . . . 0.0 109.873 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -62.83 -15.1 52.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-O 122.071 0.938 . . . . 0.0 108.663 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.626 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.93 -19.27 52.21 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.348 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.589 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.06 -56.96 4.2 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.211 -0.931 . . . . 0.0 109.48 178.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.924 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -62.51 -37.99 88.19 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.614 0.721 . . . . 0.0 109.869 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.34 -37.12 10.44 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.718 -1.239 . . . . 0.0 108.461 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -19.25 23.94 Favored 'General case' 0 C--N 1.308 -1.196 0 O-C-N 121.739 -0.601 . . . . 0.0 111.5 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.924 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.5 m-30 -43.92 -44.05 6.85 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.253 -0.904 . . . . 0.0 110.436 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.658 ' HB3' HG11 ' A' ' 48' ' ' VAL . 1.6 mptm? -74.42 13.32 0.61 Allowed 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.251 -0.906 . . . . 0.0 112.321 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.66 -82.03 0.05 OUTLIER Glycine 0 N--CA 1.489 2.218 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.77 65.04 0.99 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-O 121.848 0.832 . . . . 0.0 109.97 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -145.12 -69.35 0.02 OUTLIER Glycine 0 N--CA 1.486 2.031 0 N-CA-C 108.389 -1.885 . . . . 0.0 108.389 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.658 HG11 ' HB3' ' A' ' 44' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.291 -1.949 0 O-C-N 122.344 -0.504 . . . . 0.0 111.864 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.422 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 41.3 Cg_endo . . . . . 0 N--CA 1.482 0.809 0 N-CA-C 110.739 -0.523 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.448 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.88 13.79 19.41 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 123.141 1.448 . . . . 0.0 109.841 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.576 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -64.12 153.29 38.12 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.702 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.703 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -159.64 -29.18 0.07 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.154 -0.966 . . . . 0.0 111.705 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.488 ' HA ' HD22 ' A' ' 39' ' ' LEU . 1.5 t0 -93.43 -69.82 0.73 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.161 -0.962 . . . . 0.0 109.829 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.434 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 0.8 OUTLIER -64.19 -13.64 49.98 Favored 'General case' 0 C--N 1.287 -2.144 0 CA-C-O 121.902 0.858 . . . . 0.0 109.152 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.795 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -82.84 -17.83 42.54 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 121.308 0.575 . . . . 0.0 110.076 -179.816 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.604 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -47.72 -55.59 9.2 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.212 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.806 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -58.67 -33.55 70.25 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-O 121.963 0.887 . . . . 0.0 109.095 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.795 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -48.67 -43.05 36.5 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.978 -1.076 . . . . 0.0 108.299 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 44' ' ' LYS . 2.1 mmp_? -90.61 -16.58 28.42 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.733 -0.604 . . . . 0.0 111.591 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.806 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -42.35 -24.48 0.05 Allowed 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 110.793 -179.051 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -70.93 12.87 0.23 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.092 -1.005 . . . . 0.0 112.897 -178.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -126.28 -104.09 1.37 Allowed Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 46' ' ' ASP . 1.5 m-20 -82.15 35.63 0.44 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.374 -1.074 . . . . 0.0 110.819 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -89.82 -51.84 2.75 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 108.552 -1.819 . . . . 0.0 108.552 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.455 HG12 ' H ' ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.288 -2.081 0 CA-C-N 114.948 -0.626 . . . . 0.0 110.536 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.0 Cg_endo . . . . . 0 N--CA 1.485 0.983 0 CA-C-O 121.514 0.547 . . . . 0.0 111.602 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -79.32 2.38 21.69 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.909 1.338 . . . . 0.0 111.503 -178.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.55 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.251 0.1 OUTLIER -66.15 149.28 50.55 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.762 178.968 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.762 ' O ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -166.25 -24.87 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.993 -1.067 . . . . 0.0 112.226 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -97.2 -70.08 0.73 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.97 -1.081 . . . . 0.0 109.722 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -13.12 57.11 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 121.914 0.864 . . . . 0.0 109.031 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.702 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -81.2 -19.11 43.98 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.113 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 35' ' ' THR . 0.2 OUTLIER -50.31 -56.64 10.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.009 -1.057 . . . . 0.0 109.406 179.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.812 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -63.33 -32.25 73.61 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.42 -37.45 5.11 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.877 -1.139 . . . . 0.0 108.883 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.29 -18.58 25.35 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.645 -0.659 . . . . 0.0 111.5 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.812 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -44.29 -33.79 1.72 Allowed 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.093 -1.004 . . . . 0.0 110.101 -179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.617 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 9.6 mptt -77.51 12.18 1.7 Allowed 'General case' 0 C--N 1.308 -1.201 0 O-C-N 121.163 -0.96 . . . . 0.0 112.079 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -115.05 -100.72 2.32 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.24 33.13 0.39 Allowed 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.509 -0.995 . . . . 0.0 110.473 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.46 -51.89 3.17 Favored Glycine 0 N--CA 1.485 1.933 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.462 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.286 -2.193 0 CA-C-N 114.972 -0.614 . . . . 0.0 110.288 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo . . . . . 0 N--CA 1.483 0.865 0 CA-C-O 121.327 0.47 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.9 9.93 28.44 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 123.038 1.399 . . . . 0.0 110.242 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.553 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -60.75 151.51 29.31 Favored 'General case' 0 C--N 1.267 -2.983 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.844 179.298 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.698 ' O ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -166.49 -23.15 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.987 -1.07 . . . . 0.0 112.563 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -99.59 -70.07 0.74 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.76 -1.212 . . . . 0.0 109.868 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.89 -13.95 58.17 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-O 121.992 0.901 . . . . 0.0 108.774 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.691 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.5 -19.45 49.66 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.719 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.698 HD22 ' O ' ' A' ' 35' ' ' THR . 0.2 OUTLIER -48.92 -56.99 7.18 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.173 -0.954 . . . . 0.0 109.364 179.429 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.714 HD13 ' CG ' ' A' ' 43' ' ' PHE . 2.5 mm? -61.8 -32.35 72.64 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.666 0.746 . . . . 0.0 110.001 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.55 -36.92 4.95 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 120.943 -1.098 . . . . 0.0 108.814 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.3 OUTLIER -90.53 -19.83 23.34 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.627 -0.671 . . . . 0.0 111.644 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.714 ' CG ' HD13 ' A' ' 40' ' ' LEU . 1.2 m-85 -41.98 -41.8 2.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.214 -0.929 . . . . 0.0 110.45 -179.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.616 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.87 12.98 0.57 Allowed 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.019 -1.051 . . . . 0.0 112.364 -179.32 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -87.42 -99.81 0.87 Allowed Glycine 0 C--N 1.288 -2.096 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -81.14 38.69 0.48 Allowed 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.529 -0.983 . . . . 0.0 110.817 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -100.51 -63.07 0.79 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.424 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.287 -2.124 0 CA-C-O 121.561 0.696 . . . . 0.0 110.395 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo . . . . . 0 N--CA 1.484 0.939 0 CA-C-O 121.322 0.467 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.92 7.46 34.37 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 123.01 1.386 . . . . 0.0 110.368 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.531 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.256 0.2 OUTLIER -69.7 159.97 32.52 Favored 'General case' 0 C--N 1.266 -3.062 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.191 179.641 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.704 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -167.88 -28.64 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 O-C-N 120.922 -1.111 . . . . 0.0 111.803 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 8.9 t70 -94.78 -70.25 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.063 -1.023 . . . . 0.0 109.97 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -63.52 -14.47 51.44 Favored 'General case' 0 C--N 1.283 -2.301 0 CA-C-O 122.041 0.924 . . . . 0.0 109.091 178.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.704 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -82.04 -18.15 44.24 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.088 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -46.16 -57.11 4.8 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.353 -0.842 . . . . 0.0 109.46 179.074 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.641 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -61.13 -37.93 84.57 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.565 -0.709 . . . . 0.0 109.876 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.72 -35.48 1.85 Allowed 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.053 -1.029 . . . . 0.0 108.746 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 43' ' ' PHE . 24.7 mtp180 -91.71 -17.62 25.18 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 121.822 -0.549 . . . . 0.0 112.079 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.659 ' O ' HG12 ' A' ' 48' ' ' VAL . 0.8 OUTLIER -40.12 -61.67 0.85 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.156 -0.965 . . . . 0.0 111.027 -178.465 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.1 mptm? -77.48 13.77 1.15 Allowed 'General case' 0 C--N 1.309 -1.168 0 O-C-N 121.143 -0.973 . . . . 0.0 112.498 -179.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.94 -100.54 1.34 Allowed Glycine 0 C--N 1.287 -2.167 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.434 ' OD1' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -106.9 62.71 0.63 Allowed 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.794 -0.827 . . . . 0.0 109.733 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -145.58 -83.02 0.05 OUTLIER Glycine 0 N--CA 1.485 1.937 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.659 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.298 -1.659 0 O-C-N 121.985 -0.714 . . . . 0.0 110.848 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo . . . . . 0 N--CA 1.483 0.893 0 N-CA-C 110.859 -0.477 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.441 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -94.03 6.88 47.11 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 122.918 1.342 . . . . 0.0 110.532 -179.562 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.557 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.252 0.0 OUTLIER -75.96 142.89 41.86 Favored 'General case' 0 C--N 1.264 -3.149 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.588 179.918 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.618 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -169.05 -25.32 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.267 -0.896 . . . . 0.0 111.618 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.05 -70.38 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.98 -1.075 . . . . 0.0 109.419 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.428 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -65.47 -13.56 59.06 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.038 0.923 . . . . 0.0 108.545 178.118 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.633 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.12 -19.9 56.36 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.131 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -50.87 -56.53 11.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.28 -0.887 . . . . 0.0 109.357 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.762 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -61.73 -35.17 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.116 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.14 -36.9 1.84 Allowed 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.054 -1.029 . . . . 0.0 109.009 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.4 mtp180 -90.69 -19.57 23.45 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.627 -0.67 . . . . 0.0 111.806 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.762 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -42.24 -48.88 5.0 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.142 -0.974 . . . . 0.0 110.627 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.2 mptp? -73.62 13.42 0.48 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.17 -0.957 . . . . 0.0 112.822 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.89 -12.77 48.87 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.462 ' OD2' ' O ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -86.4 49.15 1.74 Allowed 'General case' 0 C--N 1.287 -2.122 0 O-C-N 121.766 -0.844 . . . . 0.0 110.116 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -112.8 -73.8 0.65 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.498 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.938 0 CA-C-O 121.628 0.727 . . . . 0.0 110.625 179.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo . . . . . 0 N--CA 1.483 0.891 0 N-CA-C 110.927 -0.451 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -98.81 7.52 45.97 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 123.166 1.46 . . . . 0.0 110.201 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.568 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 1.7 mmtp -69.37 153.6 43.33 Favored 'General case' 0 C--N 1.265 -3.086 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.596 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.668 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -165.66 -24.65 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.139 -0.976 . . . . 0.0 112.113 179.719 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 23.3 t0 -101.37 -69.76 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.717 -1.239 . . . . 0.0 109.276 179.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.2 -14.88 54.13 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 178.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.698 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.17 -19.54 50.68 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.654 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.69 -56.41 4.45 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.158 -0.964 . . . . 0.0 109.424 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.778 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.6 mm? -59.33 -32.39 70.05 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.848 0.832 . . . . 0.0 109.456 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.698 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -57.61 -41.48 81.37 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.497 ' O ' ' N ' ' A' ' 44' ' ' LYS . 16.3 mmt180 -90.18 -16.7 28.96 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.435 0.636 . . . . 0.0 111.205 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.778 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -39.77 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.474 -0.766 . . . . 0.0 111.318 -179.033 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.597 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.7 OUTLIER -74.1 12.83 0.64 Allowed 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.85 -1.156 . . . . 0.0 112.378 -179.198 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 47' ' ' GLY . . . -42.65 -69.87 0.56 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.5 59.87 0.06 Allowed 'General case' 0 C--N 1.288 -2.085 0 CA-C-O 121.86 0.838 . . . . 0.0 109.422 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 45' ' ' GLY . . . -140.23 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.316 -1.514 . . . . 0.0 109.316 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.475 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.771 0 O-C-N 121.943 -0.74 . . . . 0.0 111.592 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo . . . . . 0 N--CA 1.484 0.918 0 CA-C-O 121.264 0.443 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.51 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -87.24 4.53 42.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-O 123.161 1.457 . . . . 0.0 110.526 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.264 0.1 OUTLIER -70.13 160.7 31.57 Favored 'General case' 0 C--N 1.264 -3.142 0 CA-C-N 113.975 -1.466 . . . . 0.0 110.424 179.53 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.634 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.28 -22.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.645 -1.284 . . . . 0.0 112.63 179.725 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.0 -70.3 0.77 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.685 -1.26 . . . . 0.0 109.606 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -14.54 49.79 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.076 0.941 . . . . 0.0 108.647 178.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.736 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.18 -19.0 52.0 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.677 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.615 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.83 -56.44 6.28 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.112 -0.992 . . . . 0.0 109.704 179.675 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.77 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -63.41 -23.64 67.49 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.824 0.821 . . . . 0.0 109.885 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.736 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -56.78 -40.84 76.61 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.041 -1.037 . . . . 0.0 108.844 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.7 mmt-85 -89.84 -17.41 28.16 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.687 -0.633 . . . . 0.0 111.505 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.77 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -39.47 -36.93 0.42 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.399 -0.813 . . . . 0.0 110.735 -179.297 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 2.7 mptt -76.09 13.8 0.82 Allowed 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.171 -0.956 . . . . 0.0 112.638 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -127.85 -72.86 0.17 Allowed Glycine 0 N--CA 1.49 2.268 0 C-N-CA 120.115 -1.041 . . . . 0.0 110.526 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -75.71 39.56 0.17 Allowed 'General case' 0 C--N 1.289 -2.045 0 O-C-N 121.879 -0.777 . . . . 0.0 111.342 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -98.68 -62.03 0.86 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.453 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.29 -1.988 0 CA-C-O 121.613 0.721 . . . . 0.0 110.51 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.5 Cg_endo . . . . . 0 N--CA 1.486 1.048 0 CA-C-O 121.593 0.58 . . . . 0.0 111.688 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.443 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.74 5.39 32.5 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 123.027 1.394 . . . . 0.0 110.879 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.619 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.261 0.0 OUTLIER -66.43 164.52 16.13 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 114.055 -1.43 . . . . 0.0 110.655 179.912 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.656 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 1.3 m -166.16 -22.12 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.938 -1.102 . . . . 0.0 112.733 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -103.22 -70.65 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.552 -1.343 . . . . 0.0 109.81 179.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.472 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 19.7 mt-10 -63.5 -15.11 56.92 Favored 'General case' 0 C--N 1.284 -2.276 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.776 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.73 -19.11 55.75 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.306 -179.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.591 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -44.33 -55.67 4.77 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.779 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.826 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.6 mm? -60.53 -26.67 67.05 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.85 0.833 . . . . 0.0 109.384 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -58.7 -41.03 85.35 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.05 -1.031 . . . . 0.0 108.224 178.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 44' ' ' LYS . 7.2 mmm-85 -89.73 -16.22 30.81 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.393 0.616 . . . . 0.0 110.82 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.826 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -42.04 -25.08 0.06 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.382 -0.824 . . . . 0.0 110.337 -179.644 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.611 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.6 mptp? -72.45 12.97 0.39 Allowed 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.217 -0.927 . . . . 0.0 112.871 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -89.65 -101.63 1.09 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 108.663 -1.775 . . . . 0.0 108.663 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 46' ' ' ASP . 0.4 OUTLIER -85.91 33.77 0.6 Allowed 'General case' 0 C--N 1.296 -1.721 0 O-C-N 121.554 -0.968 . . . . 0.0 109.938 179.394 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -97.72 -64.93 0.89 Allowed Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.448 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.289 -2.036 0 CA-C-O 121.429 0.633 . . . . 0.0 110.477 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo . . . . . 0 N--CA 1.483 0.881 0 N-CA-C 110.939 -0.447 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.513 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.83 8.84 37.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 123.16 1.457 . . . . 0.0 110.235 -179.548 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.478 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.257 0.0 OUTLIER -62.01 157.64 18.27 Favored 'General case' 0 C--N 1.268 -2.958 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.26 179.532 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.666 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.1 -23.73 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.748 -1.22 . . . . 0.0 112.716 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t0 -101.5 -70.33 0.75 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.717 -1.239 . . . . 0.0 109.881 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.13 -14.74 52.17 Favored 'General case' 0 C--N 1.282 -2.348 0 CA-C-O 122.031 0.92 . . . . 0.0 108.572 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.691 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.85 -19.16 49.0 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.482 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -44.09 -56.2 4.2 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.881 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.5 mm? -64.91 -32.02 73.53 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.651 -0.656 . . . . 0.0 110.076 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -42.98 -33.1 0.74 Allowed 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.045 -1.034 . . . . 0.0 109.085 178.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -90.71 -17.35 26.91 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.346 0.594 . . . . 0.0 111.427 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.881 ' CD2' HD13 ' A' ' 40' ' ' LEU . 2.8 m-85 -55.49 -11.98 1.01 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.312 -0.868 . . . . 0.0 111.241 -179.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.596 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.8 mptt -70.53 13.54 0.17 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.049 -1.032 . . . . 0.0 113.207 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.84 -90.21 0.02 OUTLIER Glycine 0 N--CA 1.488 2.119 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -85.67 30.02 0.67 Allowed 'General case' 0 C--N 1.293 -1.883 0 O-C-N 121.874 -0.78 . . . . 0.0 110.521 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -88.28 -54.53 2.4 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.467 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.284 -2.245 0 CA-C-O 121.373 0.606 . . . . 0.0 110.381 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo . . . . . 0 N--CA 1.482 0.808 0 N-CA-C 110.928 -0.451 . . . . 0.0 110.928 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.45 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.6 8.91 31.83 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.214 1.483 . . . . 0.0 110.047 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.63 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.268 0.4 OUTLIER -70.66 -178.81 1.93 Allowed 'General case' 0 C--N 1.266 -3.022 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.772 179.784 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.661 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.63 -18.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.774 -1.204 . . . . 0.0 113.574 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.495 ' HA ' HD23 ' A' ' 39' ' ' LEU . 32.5 t70 -106.67 -70.97 0.77 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.384 -1.447 . . . . 0.0 110.506 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.506 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 6.4 mt-10 -63.25 -14.25 47.33 Favored 'General case' 0 C--N 1.283 -2.299 0 CA-C-O 122.25 1.024 . . . . 0.0 108.388 178.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.661 ' CE1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.37 -18.51 52.24 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.405 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.35 -57.0 3.77 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.169 179.725 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.68 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.1 mm? -61.46 -37.49 83.77 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.554 -0.716 . . . . 0.0 109.508 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.41 -33.05 5.56 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.677 -1.265 . . . . 0.0 108.006 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.403 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -90.79 -20.19 22.63 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.916 -0.49 . . . . 0.0 111.347 179.79 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.68 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -43.18 -45.86 5.75 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.22 -0.925 . . . . 0.0 109.728 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.646 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 8.4 mptt -78.53 13.13 1.7 Allowed 'General case' 0 C--N 1.308 -1.237 0 O-C-N 121.333 -0.854 . . . . 0.0 111.83 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -74.2 -91.35 0.15 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -99.42 61.94 1.21 Allowed 'General case' 0 C--N 1.295 -1.767 0 O-C-N 121.695 -0.885 . . . . 0.0 109.705 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -139.8 -72.31 0.04 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.669 -1.773 . . . . 0.0 108.669 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.896 0 CA-C-O 121.386 0.612 . . . . 0.0 111.982 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo . . . . . 0 N--CA 1.482 0.827 0 CA-C-O 121.246 0.436 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -99.36 10.29 41.68 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 123.271 1.51 . . . . 0.0 109.843 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.594 ' CD ' ' HB2' ' A' ' 38' ' ' TYR 0.266 0.1 OUTLIER -81.64 91.25 6.39 Favored 'General case' 0 C--N 1.267 -3.017 0 CA-C-N 113.798 -1.546 . . . . 0.0 110.177 179.824 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.641 ' CA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -154.5 -30.72 0.11 Allowed 'General case' 0 C--N 1.291 -1.96 0 O-C-N 121.642 -0.661 . . . . 0.0 110.569 -179.792 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 2.9 t0 -107.19 -68.72 0.88 Allowed 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -13.39 59.91 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.654 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -80.33 -19.89 45.49 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.202 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.58 -56.53 5.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.166 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.88 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.1 mm? -60.78 -35.58 76.8 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.739 0.78 . . . . 0.0 109.839 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -46.85 -38.97 11.14 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 120.847 -1.158 . . . . 0.0 108.555 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -90.82 -17.46 26.55 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.715 -0.616 . . . . 0.0 111.722 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.88 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.3 m-85 -44.66 -40.01 5.53 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 110.977 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.6 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -68.76 14.55 0.07 Allowed 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.47 -103.35 2.84 Favored Glycine 0 C--N 1.288 -2.137 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.024 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.91 65.73 0.64 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.904 0.859 . . . . 0.0 109.956 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -142.68 -75.84 0.04 OUTLIER Glycine 0 N--CA 1.485 1.905 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.634 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.3 OUTLIER . . . . . 0 C--N 1.293 -1.85 0 CA-C-O 121.398 0.618 . . . . 0.0 111.283 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.502 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.3 Cg_endo . . . . . 0 N--CA 1.483 0.89 0 CA-C-O 121.348 0.478 . . . . 0.0 111.28 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -93.88 12.87 24.44 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 123.279 1.514 . . . . 0.0 110.088 -179.557 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.563 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.26 0.1 OUTLIER -60.67 157.19 15.1 Favored 'General case' 0 C--N 1.265 -3.07 0 CA-C-N 113.957 -1.474 . . . . 0.0 110.641 179.473 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.672 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -165.5 -27.04 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.928 -1.108 . . . . 0.0 111.797 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.4 OUTLIER -97.33 -70.85 0.7 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.915 -1.115 . . . . 0.0 109.774 179.488 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -63.55 -14.65 53.32 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 122.005 0.907 . . . . 0.0 108.667 178.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.765 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -78.58 -19.79 51.99 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.266 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -45.62 -56.04 5.65 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.214 -0.929 . . . . 0.0 108.994 178.619 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.96 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -62.37 -24.83 67.58 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 121.844 0.831 . . . . 0.0 109.758 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -55.22 -44.76 75.73 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.085 -1.009 . . . . 0.0 108.567 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.433 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.1 OUTLIER -89.49 -17.78 27.99 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.382 0.61 . . . . 0.0 110.998 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.96 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -41.05 -44.31 2.39 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.419 -0.8 . . . . 0.0 110.335 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.619 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 12.0 mptt -73.0 14.37 0.29 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.043 -1.036 . . . . 0.0 113.151 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -156.46 -99.24 0.16 Allowed Glycine 0 N--CA 1.489 2.225 0 C-N-CA 119.491 -1.337 . . . . 0.0 111.702 -179.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.45 58.85 3.27 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.677 -0.896 . . . . 0.0 110.252 -178.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.73 -67.35 0.1 OUTLIER Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.202 -1.959 . . . . 0.0 108.202 179.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.901 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.424 ' O ' ' N ' ' A' ' 26' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.21 0.528 . . . . 0.0 110.127 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -42.78 99.26 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.281 -0.887 . . . . 0.0 110.341 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -178.68 101.19 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.276 -0.89 . . . . 0.0 110.466 179.661 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.467 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 41.92 87.32 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.353 -0.842 . . . . 0.0 110.66 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.467 ' O ' ' O ' ' A' ' 27' ' ' GLU . 1.7 mttt -55.11 -164.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.3 -0.875 . . . . 0.0 110.222 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -45.75 148.59 0.73 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.215 -0.928 . . . . 0.0 110.444 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.465 ' O ' ' O ' ' A' ' 31' ' ' GLY . 0.2 OUTLIER -48.87 137.17 12.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 110.712 -179.699 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.465 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 41.26 -165.34 0.01 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 110.326 -1.109 . . . . 0.0 110.326 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -67.64 160.31 48.67 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 124.219 1.642 . . . . 0.0 111.217 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.451 ' CG ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.95 14.67 31.31 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-O 123.021 1.391 . . . . 0.0 110.171 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.577 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.258 0.1 OUTLIER -56.35 159.9 3.35 Favored 'General case' 0 C--N 1.267 -2.993 0 CA-C-N 114.006 -1.452 . . . . 0.0 110.66 179.75 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.698 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -163.5 -19.74 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.954 -1.091 . . . . 0.0 113.142 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -103.09 -70.42 0.76 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.43 -1.419 . . . . 0.0 110.024 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.01 -13.77 60.48 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-O 122.18 0.99 . . . . 0.0 108.506 178.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.791 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.9 -20.01 53.67 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.236 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.679 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.54 -55.82 5.81 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.197 -0.939 . . . . 0.0 108.762 178.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.878 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.8 mm? -58.77 -25.89 63.49 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-O 121.679 0.752 . . . . 0.0 109.489 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.791 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -62.99 -50.57 70.21 Favored 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -86.89 -14.53 41.68 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.629 -0.67 . . . . 0.0 110.464 179.688 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.878 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.6 OUTLIER -40.32 -42.36 1.53 Allowed 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 121.38 0.609 . . . . 0.0 110.239 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -75.76 13.63 0.79 Allowed 'General case' 0 C--N 1.307 -1.28 0 O-C-N 121.322 -0.861 . . . . 0.0 112.77 -178.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -131.64 -104.99 1.0 Allowed Glycine 0 C--N 1.288 -2.111 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.603 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 1.9 m-20 -91.29 33.04 0.99 Allowed 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.67 -0.9 . . . . 0.0 110.991 -178.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.626 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -84.4 -48.55 5.0 Favored Glycine 0 N--CA 1.488 2.154 0 N-CA-C 108.398 -1.881 . . . . 0.0 108.398 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.501 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -57.87 -46.79 87.33 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.325 0 CA-C-N 114.521 -0.84 . . . . 0.0 111.012 179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 1.1 ptpt -42.93 -59.37 2.02 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.136 -0.977 . . . . 0.0 111.795 -178.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.752 ' CD1' HD12 ' A' ' 54' ' ' LEU . 5.5 p90 -86.26 -28.19 23.95 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 120.579 -1.325 . . . . 0.0 110.6 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.662 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.7 OUTLIER -48.71 -54.31 15.36 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.645 -1.284 . . . . 0.0 109.029 179.203 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.634 ' O ' HG23 ' A' ' 57' ' ' ILE . . . -53.34 -53.85 45.0 Favored 'General case' 0 C--N 1.285 -2.198 0 CA-C-O 122.522 1.153 . . . . 0.0 110.486 179.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.501 ' HA ' HG12 ' A' ' 57' ' ' ILE . 23.7 mtmt -67.39 -53.32 30.27 Favored 'General case' 0 C--N 1.284 -2.251 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.792 -178.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.752 HD12 ' CD1' ' A' ' 50' ' ' TYR . 33.4 mt -51.21 -21.63 2.17 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 120.817 -1.177 . . . . 0.0 110.756 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.704 HG22 ' N ' ' A' ' 56' ' ' GLY 0.329 0.3 OUTLIER -75.52 -57.97 5.39 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.845 0 CA-C-O 121.508 0.67 . . . . 0.0 109.751 179.721 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.704 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 133.8 50.97 0.08 OUTLIER Glycine 0 C--N 1.303 -1.267 0 N-CA-C 110.402 -1.079 . . . . 0.0 110.402 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.634 HG23 ' O ' ' A' ' 52' ' ' ALA 0.264 4.4 pt -78.16 -122.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.167 0 CA-C-O 122.68 1.228 . . . . 0.0 110.075 179.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--N 1.259 -3.334 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.275 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.257 0.551 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.69 157.51 0.76 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.253 -0.904 . . . . 0.0 110.53 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.486 ' O ' ' O ' ' A' ' 27' ' ' GLU . 6.9 mmtm -63.5 -11.35 23.28 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.293 -0.879 . . . . 0.0 110.644 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.536 ' O ' ' N ' ' A' ' 29' ' ' LYS . 27.3 tp10 57.89 125.77 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.444 -0.785 . . . . 0.0 110.443 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -40.89 90.45 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.314 -0.866 . . . . 0.0 111.323 -179.738 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' A' ' 27' ' ' GLU . 0.6 OUTLIER -57.19 170.65 0.46 Allowed 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.193 -0.942 . . . . 0.0 110.308 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.524 ' CG ' ' O ' ' A' ' 30' ' ' LYS . 11.7 pttt -50.85 91.22 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.28 -0.888 . . . . 0.0 110.96 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.473 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 51.17 172.42 0.01 OUTLIER Glycine 0 N--CA 1.487 2.085 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 179.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -70.13 156.41 62.44 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 124.005 1.529 . . . . 0.0 111.026 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -96.28 13.87 26.11 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 123.14 1.447 . . . . 0.0 109.833 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.557 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.255 4.5 mmtp -70.54 157.0 38.67 Favored 'General case' 0 C--N 1.267 -2.978 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.785 -179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.622 ' C ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -167.19 -27.08 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 O-C-N 121.086 -1.009 . . . . 0.0 111.779 179.595 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.519 ' HA ' HD23 ' A' ' 39' ' ' LEU . 26.7 t70 -101.64 -69.96 0.76 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.04 -1.037 . . . . 0.0 109.522 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.547 ' CB ' ' HE2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -61.35 -16.13 43.1 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-O 122.077 0.942 . . . . 0.0 108.568 178.234 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.734 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -78.47 -18.98 54.08 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.298 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.597 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.39 -57.12 4.29 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.271 -0.893 . . . . 0.0 109.545 179.284 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.786 HD13 ' CG ' ' A' ' 43' ' ' PHE . 2.2 mm? -61.53 -32.75 72.82 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.549 -0.719 . . . . 0.0 109.717 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.734 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -44.36 -32.47 1.34 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 120.934 -1.104 . . . . 0.0 108.67 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -91.22 -16.91 26.89 Favored 'General case' 0 C--N 1.309 -1.192 0 O-C-N 121.729 -0.607 . . . . 0.0 111.649 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.786 ' CG ' HD13 ' A' ' 40' ' ' LEU . 1.4 m-85 -48.68 -17.61 0.19 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.291 -0.881 . . . . 0.0 111.41 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.8 OUTLIER -68.58 13.45 0.1 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.941 -1.099 . . . . 0.0 113.269 -178.608 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.508 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -89.32 -93.72 1.12 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.479 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -99.46 60.59 1.15 Allowed 'General case' 0 C--N 1.297 -1.691 0 O-C-N 121.709 -0.877 . . . . 0.0 109.541 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.568 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -141.57 -77.48 0.05 OUTLIER Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.136 -1.586 . . . . 0.0 109.136 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.427 ' CG1' ' HA ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -55.06 -44.42 74.2 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.745 0 O-C-N 122.103 -0.645 . . . . 0.0 110.903 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 1.9 ptpt -41.56 -59.3 1.65 Allowed 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.369 -0.832 . . . . 0.0 111.657 -178.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.684 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.5 p90 -92.17 -27.85 17.43 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.402 -1.436 . . . . 0.0 110.967 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.684 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -45.27 -56.19 5.13 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 120.885 -1.134 . . . . 0.0 109.601 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.529 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -61.02 -53.35 58.24 Favored 'General case' 0 C--N 1.284 -2.243 0 CA-C-O 122.576 1.179 . . . . 0.0 110.758 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.453 ' HB2' ' HA ' ' A' ' 50' ' ' TYR . 10.7 mttt -58.17 -51.51 69.42 Favored 'General case' 0 C--N 1.283 -2.325 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.96 -178.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 40.3 mt -51.13 -27.84 9.46 Favored 'General case' 0 C--N 1.309 -1.183 0 O-C-N 120.689 -1.257 . . . . 0.0 110.883 -179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.686 HG22 ' N ' ' A' ' 56' ' ' GLY 0.329 0.3 OUTLIER -75.58 -56.44 8.61 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.993 0 CA-C-O 121.683 0.754 . . . . 0.0 109.887 179.564 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.686 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 121.99 48.33 0.27 Allowed Glycine 0 C--N 1.302 -1.352 0 N-CA-C 109.886 -1.285 . . . . 0.0 109.886 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.541 HG23 HG22 ' A' ' 55' ' ' ILE 0.263 1.9 pt -74.77 -120.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.204 0 CA-C-O 122.641 1.21 . . . . 0.0 110.177 179.939 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.424 ' H ' HD12 ' A' ' 57' ' ' ILE . 16.9 t70 . . . . . 0 C--N 1.259 -3.329 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.281 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.332 0.587 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.41 ' O ' ' C ' ' A' ' 26' ' ' LYS . 9.8 mmtt -49.75 145.12 5.52 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.223 -0.923 . . . . 0.0 110.785 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' A' ' 27' ' ' GLU . 1.8 tptt -42.28 -65.35 0.47 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.395 -0.816 . . . . 0.0 110.287 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.466 ' O ' ' O ' ' A' ' 26' ' ' LYS . 13.6 tp10 54.37 164.89 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.342 -0.849 . . . . 0.0 110.218 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.457 ' O ' ' O ' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -50.35 -178.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.281 -0.887 . . . . 0.0 111.036 -179.446 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -54.12 -161.16 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 121.696 0.76 . . . . 0.0 111.154 -179.85 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' GLY . 0.0 OUTLIER -51.84 -166.82 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 121.588 0.709 . . . . 0.0 111.15 -179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -53.54 -163.2 0.01 OUTLIER Glycine 0 N--CA 1.486 1.997 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.516 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 41.2 Cg_endo -66.28 -167.22 0.12 Allowed 'Trans proline' 0 C--N 1.303 -1.837 0 O-C-N 124.166 1.614 . . . . 0.0 111.367 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.16 10.69 23.51 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.886 1.326 . . . . 0.0 110.537 -179.271 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 38' ' ' TYR 0.258 0.0 OUTLIER -63.33 114.79 4.04 Favored 'General case' 0 C--N 1.264 -3.132 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.035 179.552 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.679 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -140.44 -13.84 1.0 Allowed 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 118.931 -1.107 . . . . 0.0 112.418 -179.414 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.463 ' HA ' HD23 ' A' ' 39' ' ' LEU . 63.8 t0 -107.1 -70.32 0.8 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.153 -0.967 . . . . 0.0 109.785 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -63.2 -15.78 58.05 Favored 'General case' 0 C--N 1.283 -2.319 0 CA-C-O 122.207 1.004 . . . . 0.0 108.466 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.679 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.97 -18.61 49.9 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.673 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.23 -56.99 4.96 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.156 -0.965 . . . . 0.0 109.588 179.636 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.895 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -61.16 -35.93 78.46 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.471 -0.768 . . . . 0.0 109.59 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.675 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -46.25 -35.36 5.16 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 120.952 -1.093 . . . . 0.0 108.5 178.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -90.82 -18.34 25.05 Favored 'General case' 0 C--N 1.309 -1.188 0 O-C-N 121.804 -0.56 . . . . 0.0 111.44 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.895 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.2 m-85 -45.73 -26.62 0.67 Allowed 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.164 -0.96 . . . . 0.0 110.235 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.628 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.6 mptp? -75.67 13.37 0.82 Allowed 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.351 -0.843 . . . . 0.0 112.559 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.498 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -86.3 -95.09 0.83 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.444 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -95.11 59.62 2.28 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.751 -0.853 . . . . 0.0 109.56 -179.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.523 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -139.31 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.485 1.959 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.428 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -53.45 -45.39 57.77 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.801 0 CA-C-O 121.456 0.646 . . . . 0.0 111.328 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -41.36 -58.79 1.75 Allowed 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.504 -0.747 . . . . 0.0 111.981 -177.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.66 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.1 p90 -91.95 -27.14 18.07 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.341 -1.474 . . . . 0.0 111.39 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.66 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -54.46 -44.47 72.59 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 120.662 -1.273 . . . . 0.0 109.576 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.505 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -58.45 -54.1 50.81 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-O 122.474 1.131 . . . . 0.0 110.19 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 10.4 mtpp -69.11 -54.09 16.83 Favored 'General case' 0 C--N 1.283 -2.313 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.933 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 29.9 mt -51.59 -21.73 2.78 Favored 'General case' 0 C--N 1.308 -1.197 0 O-C-N 120.84 -1.162 . . . . 0.0 110.34 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 1.055 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -76.12 -59.19 3.42 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 CA-C-O 121.585 0.707 . . . . 0.0 109.849 179.809 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.714 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 84.54 52.96 3.37 Favored Glycine 0 N--CA 1.479 1.5 0 C-N-CA 120.266 -0.969 . . . . 0.0 111.496 178.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.055 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.255 1.5 pt -71.88 -119.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 CA-C-O 122.595 1.188 . . . . 0.0 110.058 179.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.513 ' H ' HD12 ' A' ' 57' ' ' ILE . 31.7 t70 . . . . . 0 C--N 1.26 -3.311 0 CA-C-N 114.673 -1.148 . . . . 0.0 110.528 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.415 ' O ' ' C ' ' A' ' 25' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 121.262 0.554 . . . . 0.0 110.258 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.53 ' O ' ' N ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER 43.43 -159.76 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 110.325 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.5 tptt -42.9 90.49 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.465 -0.772 . . . . 0.0 110.766 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 25' ' ' LYS . 3.5 pt-20 -60.58 158.62 12.04 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 121.231 -0.918 . . . . 0.0 110.781 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 14.7 tttp -50.56 131.47 25.17 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.345 -0.847 . . . . 0.0 110.558 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 31' ' ' GLY . 10.6 ttpp -44.5 108.45 0.12 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.249 -0.907 . . . . 0.0 110.469 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.472 ' O ' ' O ' ' A' ' 31' ' ' GLY . 0.0 OUTLIER -62.16 73.21 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.282 -0.886 . . . . 0.0 110.522 -179.81 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 29' ' ' LYS . . . 43.73 -168.56 0.02 OUTLIER Glycine 0 N--CA 1.485 1.962 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.37 167.99 22.33 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.035 1.545 . . . . 0.0 111.161 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -95.38 17.0 15.36 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-O 123.198 1.475 . . . . 0.0 109.473 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.575 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.259 0.1 OUTLIER -50.94 151.62 2.48 Favored 'General case' 0 C--N 1.269 -2.902 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.02 179.966 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.626 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -157.45 -27.0 0.09 Allowed 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.207 -0.933 . . . . 0.0 111.975 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -98.58 -69.79 0.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.921 -1.112 . . . . 0.0 109.579 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HA ' ' OE1' ' A' ' 37' ' ' GLU . 1.9 mm-40 -61.88 -15.04 39.4 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 121.965 0.888 . . . . 0.0 109.056 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.731 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -80.68 -19.28 45.52 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.876 -179.51 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.671 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -45.9 -56.46 5.41 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 120.99 -1.069 . . . . 0.0 109.343 178.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.773 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -60.33 -34.75 74.27 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.69 0.757 . . . . 0.0 109.734 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.731 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.61 -35.64 1.83 Allowed 'General case' 0 C--N 1.3 -1.551 0 O-C-N 120.902 -1.124 . . . . 0.0 108.746 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -90.76 -19.1 23.88 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.712 -0.617 . . . . 0.0 111.417 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.773 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -46.46 -38.61 9.38 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.206 -0.934 . . . . 0.0 110.32 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.0 OUTLIER -75.19 13.2 0.75 Allowed 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.345 -0.847 . . . . 0.0 112.796 -178.47 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -170.46 -94.69 0.1 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.609 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 2.5 m-20 -76.21 38.33 0.17 Allowed 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.628 -0.924 . . . . 0.0 111.419 -179.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.607 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -88.46 -50.32 3.42 Favored Glycine 0 N--CA 1.487 2.084 0 N-CA-C 108.142 -1.983 . . . . 0.0 108.142 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.454 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -56.25 -45.38 81.12 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.138 0 CA-C-N 114.702 -0.749 . . . . 0.0 111.079 179.616 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.562 ' HE3' ' N ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -42.28 -59.94 1.65 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.301 -0.874 . . . . 0.0 111.73 -177.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.685 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.4 p90 -87.25 -27.55 22.87 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 120.272 -1.518 . . . . 0.0 110.684 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.685 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 9.5 mmtt -47.29 -56.52 6.64 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 120.883 -1.136 . . . . 0.0 109.394 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.517 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -49.87 -53.72 23.99 Favored 'General case' 0 C--N 1.283 -2.288 0 CA-C-O 122.427 1.108 . . . . 0.0 110.639 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.6 mttm -67.77 -52.84 32.54 Favored 'General case' 0 C--N 1.284 -2.276 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.033 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.54 HD12 ' CD1' ' A' ' 50' ' ' TYR . 27.3 mt -50.98 -20.79 1.47 Allowed 'General case' 0 C--N 1.308 -1.21 0 O-C-N 120.731 -1.23 . . . . 0.0 110.908 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.714 HG22 ' N ' ' A' ' 56' ' ' GLY 0.329 0.3 OUTLIER -75.13 -57.42 6.44 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.87 0 CA-C-O 121.478 0.656 . . . . 0.0 109.897 179.666 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.714 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 129.72 51.06 0.11 Allowed Glycine 0 N--CA 1.475 1.273 0 C-N-CA 120.098 -1.049 . . . . 0.0 110.772 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 52' ' ' ALA 0.263 2.4 pt -75.97 -120.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.138 0 CA-C-O 122.617 1.199 . . . . 0.0 110.018 179.504 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.44 ' OXT' ' O ' ' A' ' 57' ' ' ILE . 5.1 t0 . . . . . 0 C--N 1.259 -3.359 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.146 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.409 0.623 . . . . 0.0 110.0 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.404 ' O ' ' CG ' ' A' ' 25' ' ' LYS . 11.9 ptmt -45.57 112.01 0.41 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.257 -0.902 . . . . 0.0 110.581 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.451 ' O ' ' C ' ' A' ' 27' ' ' GLU . 1.4 ttmt -51.27 104.34 0.08 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.193 -0.942 . . . . 0.0 110.178 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.527 ' N ' ' OE2' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -36.68 102.94 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.619 -0.676 . . . . 0.0 111.042 -179.699 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 29' ' ' LYS . 0.6 OUTLIER -41.14 -34.21 0.43 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.261 -0.899 . . . . 0.0 110.252 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -50.73 -174.26 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.376 -0.827 . . . . 0.0 110.362 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' A' ' 31' ' ' GLY . 3.9 mttt -43.64 123.19 3.01 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.148 -0.97 . . . . 0.0 110.075 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.463 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -44.31 169.99 0.01 OUTLIER Glycine 0 N--CA 1.486 2.019 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -67.98 -173.46 0.51 Allowed 'Trans proline' 0 C--N 1.303 -1.829 0 O-C-N 124.082 1.57 . . . . 0.0 110.756 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.46 2.08 53.52 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 123.145 1.45 . . . . 0.0 110.166 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.513 ' HD3' ' HB3' ' A' ' 38' ' ' TYR 0.251 1.3 mmtp -67.91 153.77 43.0 Favored 'General case' 0 C--N 1.264 -3.139 0 CA-C-N 113.997 -1.456 . . . . 0.0 110.046 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.679 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.09 -24.67 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.05 -1.031 . . . . 0.0 112.236 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -70.75 0.71 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.916 -1.115 . . . . 0.0 110.014 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -64.73 -13.35 54.44 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-O 122.002 0.906 . . . . 0.0 108.765 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.791 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.57 -19.58 49.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.428 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -47.47 -56.64 6.61 Favored 'General case' 0 C--N 1.306 -1.283 0 O-C-N 121.065 -1.022 . . . . 0.0 109.152 178.893 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.612 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 1.8 mm? -58.64 -34.15 70.87 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.856 0.836 . . . . 0.0 109.219 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.791 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.22 -35.87 8.13 Favored 'General case' 0 C--N 1.297 -1.716 0 O-C-N 120.928 -1.108 . . . . 0.0 108.049 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.462 ' HD3' ' OD1' ' A' ' 46' ' ' ASP . 3.4 mtt180 -90.5 -20.61 22.49 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 121.809 -0.557 . . . . 0.0 111.452 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.612 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 1.1 m-85 -42.66 -34.83 0.96 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.205 -0.934 . . . . 0.0 109.965 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.5 mptt -77.81 13.29 1.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.416 -0.803 . . . . 0.0 112.224 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.474 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -151.54 -96.01 0.13 Allowed Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.004 -1.238 . . . . 0.0 110.004 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.51 ' HA ' ' CD ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -84.35 55.78 3.5 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.716 -0.873 . . . . 0.0 109.284 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -129.88 -77.82 0.19 Allowed Glycine 0 N--CA 1.487 2.099 0 N-CA-C 108.379 -1.889 . . . . 0.0 108.379 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.458 HG12 ' H ' ' A' ' 48' ' ' VAL . 0.2 OUTLIER -54.12 -41.64 51.9 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.825 0 O-C-N 122.003 -0.704 . . . . 0.0 110.499 179.189 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' CD ' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -41.12 -59.45 1.49 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.675 -0.641 . . . . 0.0 112.069 -177.776 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.67 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 4.1 p90 -91.28 -28.58 17.68 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.279 -1.513 . . . . 0.0 111.293 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.67 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.5 OUTLIER -53.9 -44.06 70.2 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.522 -1.362 . . . . 0.0 109.44 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.526 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -71.16 -52.09 21.17 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.643 1.211 . . . . 0.0 110.087 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.501 ' HB2' ' HA ' ' A' ' 50' ' ' TYR . 44.8 mttt -58.89 -52.53 65.34 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.729 -179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 46.4 mt -51.44 -27.78 11.23 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 120.733 -1.23 . . . . 0.0 110.836 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.689 HG22 ' N ' ' A' ' 56' ' ' GLY 0.331 0.3 OUTLIER -75.21 -55.21 12.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 CA-C-O 121.591 0.71 . . . . 0.0 110.15 -179.89 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.689 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 110.35 51.5 0.62 Allowed Glycine 0 C--N 1.3 -1.464 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.665 HG23 HG22 ' A' ' 55' ' ' ILE 0.262 2.4 pt -72.68 -119.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.232 0 CA-C-O 122.527 1.156 . . . . 0.0 110.271 179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.422 ' C ' ' O ' ' A' ' 57' ' ' ILE . 27.0 t0 . . . . . 0 C--N 1.26 -3.291 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.452 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.439 ' O ' ' C ' ' A' ' 25' ' ' LYS . 13.5 p . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.142 0.496 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' A' ' 26' ' ' LYS . 2.2 tmtm? -41.28 -57.54 2.1 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.335 -0.853 . . . . 0.0 110.316 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.475 ' O ' ' O ' ' A' ' 27' ' ' GLU . 0.2 OUTLIER 49.4 -179.1 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.17 -0.956 . . . . 0.0 109.957 179.63 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.475 ' O ' ' O ' ' A' ' 26' ' ' LYS . 1.7 tt0 -52.19 -172.16 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.349 0 O-C-N 121.211 -0.931 . . . . 0.0 109.772 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.522 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -41.08 163.33 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.263 -0.898 . . . . 0.0 110.177 179.716 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 tttp -64.56 58.43 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.194 -0.942 . . . . 0.0 111.05 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 28' ' ' LYS . 14.6 ptpt -50.35 150.51 2.53 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.068 -1.02 . . . . 0.0 110.717 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -56.2 -160.58 0.02 OUTLIER Glycine 0 N--CA 1.483 1.771 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.548 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.2 Cg_endo -65.16 -164.98 0.07 OUTLIER 'Trans proline' 0 C--N 1.301 -1.938 0 O-C-N 124.31 1.689 . . . . 0.0 111.065 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.446 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.6 9.34 16.36 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 122.908 1.337 . . . . 0.0 111.039 -178.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.563 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.262 0.0 OUTLIER -60.72 161.22 8.17 Favored 'General case' 0 C--N 1.262 -3.219 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.22 179.352 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.658 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -163.79 -26.66 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.309 0 O-C-N 120.724 -1.235 . . . . 0.0 112.402 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -97.17 -70.55 0.71 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.794 -1.191 . . . . 0.0 110.104 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.1 -13.78 50.13 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.968 0.889 . . . . 0.0 109.022 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.781 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.88 -19.52 48.06 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.186 -179.434 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.734 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -49.31 -55.69 11.98 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 120.804 -1.185 . . . . 0.0 108.793 178.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.663 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -59.19 -25.76 64.23 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.932 0.872 . . . . 0.0 109.341 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.781 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -54.3 -37.58 64.95 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 120.957 -1.09 . . . . 0.0 108.197 178.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' LYS . 18.3 mmm180 -90.23 -18.33 25.88 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.412 0.625 . . . . 0.0 111.187 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.663 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.1 m-85 -43.33 -23.12 0.05 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.311 -0.868 . . . . 0.0 110.799 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.606 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.53 12.81 0.56 Allowed 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.108 -0.995 . . . . 0.0 112.441 -178.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.506 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -74.0 -84.16 0.31 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 110.089 -1.204 . . . . 0.0 110.089 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.494 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -94.25 59.39 2.61 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-O 121.617 0.722 . . . . 0.0 109.484 -179.896 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.539 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -139.83 -76.98 0.05 OUTLIER Glycine 0 N--CA 1.487 2.071 0 N-CA-C 109.25 -1.54 . . . . 0.0 109.25 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.438 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -53.19 -45.06 54.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 O-C-N 122.094 -0.65 . . . . 0.0 110.702 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.2 OUTLIER -41.64 -59.35 1.66 Allowed 'General case' 0 C--N 1.297 -1.698 0 O-C-N 121.458 -0.776 . . . . 0.0 111.59 -178.333 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.66 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.5 p90 -92.77 -26.69 17.61 Favored 'General case' 0 C--N 1.307 -1.262 0 O-C-N 120.307 -1.496 . . . . 0.0 110.719 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.66 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 4.0 mmtt -48.82 -47.71 42.19 Favored 'General case' 0 C--N 1.305 -1.334 0 O-C-N 120.834 -1.166 . . . . 0.0 109.306 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.516 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -62.03 -54.45 41.37 Favored 'General case' 0 C--N 1.286 -2.192 0 CA-C-O 122.43 1.109 . . . . 0.0 109.89 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -53.29 59.87 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.228 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 31.3 mt -51.3 -28.36 11.86 Favored 'General case' 0 C--N 1.308 -1.214 0 O-C-N 120.88 -1.137 . . . . 0.0 110.503 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.699 HG22 ' N ' ' A' ' 56' ' ' GLY 0.331 0.2 OUTLIER -75.25 -56.71 7.96 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.886 0 CA-C-O 121.552 0.691 . . . . 0.0 110.029 179.654 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.699 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 123.65 50.2 0.21 Allowed Glycine 0 C--N 1.302 -1.357 0 N-CA-C 110.236 -1.146 . . . . 0.0 110.236 179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.455 HD13 ' HB1' ' A' ' 52' ' ' ALA 0.259 3.5 pt -73.93 -119.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.168 0 CA-C-O 122.602 1.192 . . . . 0.0 110.239 179.734 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 t0 . . . . . 0 C--N 1.26 -3.311 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.105 -179.717 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 25' ' ' LYS . 94.7 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.192 0.52 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.447 ' O ' ' O ' ' A' ' 24' ' ' SER . 0.0 OUTLIER 54.54 166.26 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.308 -0.87 . . . . 0.0 110.239 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 27' ' ' GLU . 1.3 mmtt -52.51 178.1 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.283 -0.885 . . . . 0.0 110.548 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.462 ' O ' ' O ' ' A' ' 26' ' ' LYS . 0.9 OUTLIER 56.82 119.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.533 -0.73 . . . . 0.0 110.952 179.539 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.474 ' O ' ' O ' ' A' ' 29' ' ' LYS . 10.0 tptp -50.01 179.6 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.472 -0.767 . . . . 0.0 110.458 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.538 ' O ' ' N ' ' A' ' 31' ' ' GLY . 1.9 ttpm? -38.06 160.53 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.604 -0.685 . . . . 0.0 110.742 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 31' ' ' GLY . 7.6 mmtt -42.32 91.87 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.35 -0.844 . . . . 0.0 110.529 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.538 ' N ' ' O ' ' A' ' 29' ' ' LYS . . . -52.15 -173.28 0.03 OUTLIER Glycine 0 N--CA 1.485 1.9 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.53 -170.09 0.24 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.075 1.566 . . . . 0.0 110.734 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -91.18 7.3 41.36 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 123.234 1.492 . . . . 0.0 110.271 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.546 ' NZ ' ' HB2' ' A' ' 37' ' ' GLU 0.259 0.3 OUTLIER -73.44 138.08 44.96 Favored 'General case' 0 C--N 1.263 -3.166 0 CA-C-N 113.896 -1.502 . . . . 0.0 110.446 179.742 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.625 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -170.76 -25.99 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.257 -0.902 . . . . 0.0 111.403 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -102.79 -69.74 0.78 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.139 -0.976 . . . . 0.0 109.059 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.546 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 4.7 mt-10 -63.13 -15.1 55.66 Favored 'General case' 0 C--N 1.282 -2.328 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.625 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.73 -19.52 52.16 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.326 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.585 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -45.64 -56.35 5.3 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.121 -0.987 . . . . 0.0 109.541 179.034 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.823 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -62.73 -37.94 88.51 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 121.616 0.722 . . . . 0.0 110.046 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.58 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.81 -39.28 8.18 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.823 -1.173 . . . . 0.0 108.792 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.446 ' HD3' ' HB2' ' A' ' 46' ' ' ASP . 8.0 mtt180 -91.0 -17.21 26.66 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.714 -0.616 . . . . 0.0 111.767 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.823 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.5 m-85 -44.16 -42.28 6.3 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.217 -0.927 . . . . 0.0 110.96 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.604 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -73.34 12.93 0.5 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.191 -0.943 . . . . 0.0 112.966 -178.58 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -160.27 -96.66 0.11 Allowed Glycine 0 C--N 1.286 -2.217 0 C-N-CA 120.013 -1.089 . . . . 0.0 110.404 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.622 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.9 m-20 -75.55 36.44 0.13 Allowed 'General case' 0 C--N 1.296 -1.735 0 O-C-N 121.617 -0.931 . . . . 0.0 112.011 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.618 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -88.57 -50.12 3.45 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.415 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -57.45 -46.07 85.74 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.214 0 CA-C-N 114.763 -0.718 . . . . 0.0 110.884 179.667 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.622 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -42.92 -59.39 2.01 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.394 -0.816 . . . . 0.0 112.436 -178.144 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.679 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 7.3 p90 -81.04 -36.05 31.05 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 120.349 -1.469 . . . . 0.0 111.145 -179.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.679 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -54.4 -45.31 72.88 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 120.24 -1.538 . . . . 0.0 108.749 178.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.52 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -64.19 -53.28 51.83 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.462 1.125 . . . . 0.0 110.534 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.1 mmpt? -67.22 -51.04 58.14 Favored 'General case' 0 C--N 1.283 -2.316 0 CA-C-N 115.228 -0.896 . . . . 0.0 112.098 -178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 40.9 mt -50.84 -21.23 1.58 Allowed 'General case' 0 C--N 1.308 -1.224 0 O-C-N 120.759 -1.213 . . . . 0.0 110.947 -178.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 1.021 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -74.88 -56.43 8.92 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.984 0 CA-C-O 121.601 0.715 . . . . 0.0 109.526 179.445 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.677 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 85.79 53.58 2.99 Favored Glycine 0 N--CA 1.477 1.416 0 C-N-CA 119.983 -1.103 . . . . 0.0 111.113 178.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.021 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.253 1.9 pt -70.85 -118.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.223 0 CA-C-O 122.611 1.196 . . . . 0.0 109.918 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.432 ' C ' ' O ' ' A' ' 57' ' ' ILE . 6.3 t70 . . . . . 0 C--N 1.258 -3.373 0 CA-C-N 114.763 -1.108 . . . . 0.0 110.267 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.7 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.421 0.629 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.457 ' O ' ' O ' ' A' ' 26' ' ' LYS . 0.8 OUTLIER -65.2 -9.8 26.34 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.221 -0.925 . . . . 0.0 110.698 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.482 ' HB3' ' OE2' ' A' ' 27' ' ' GLU . 0.7 OUTLIER -49.83 -177.88 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.909 . . . . 0.0 110.769 -179.539 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.482 ' OE2' ' HB3' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -43.25 141.86 1.18 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.39 -0.819 . . . . 0.0 110.891 -179.607 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -59.92 -166.05 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.281 -0.887 . . . . 0.0 110.645 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.476 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -44.96 174.05 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.432 -0.792 . . . . 0.0 110.622 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 29' ' ' LYS . 1.7 mttm -47.33 173.79 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.239 -0.913 . . . . 0.0 110.011 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -178.32 -179.59 48.3 Favored Glycine 0 N--CA 1.474 1.217 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -69.06 163.08 39.09 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 O-C-N 123.939 1.494 . . . . 0.0 110.848 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.97 12.63 33.56 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 123.155 1.455 . . . . 0.0 109.848 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.565 ' CD ' ' HB3' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -61.49 158.39 14.99 Favored 'General case' 0 C--N 1.267 -3.0 0 CA-C-N 113.925 -1.489 . . . . 0.0 110.52 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.626 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.53 -24.92 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.293 0 O-C-N 121.028 -1.045 . . . . 0.0 112.395 179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.454 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 m-20 -100.2 -70.41 0.74 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.814 -1.179 . . . . 0.0 109.873 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -62.83 -15.1 52.86 Favored 'General case' 0 C--N 1.284 -2.245 0 CA-C-O 122.071 0.938 . . . . 0.0 108.663 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.626 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -78.93 -19.27 52.21 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.348 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.589 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -45.06 -56.96 4.2 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.211 -0.931 . . . . 0.0 109.48 178.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.924 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -62.51 -37.99 88.19 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-O 121.614 0.721 . . . . 0.0 109.869 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.34 -37.12 10.44 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 120.718 -1.239 . . . . 0.0 108.461 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -19.25 23.94 Favored 'General case' 0 C--N 1.308 -1.196 0 O-C-N 121.739 -0.601 . . . . 0.0 111.5 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.924 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.5 m-30 -43.92 -44.05 6.85 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.253 -0.904 . . . . 0.0 110.436 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.658 ' HB3' HG11 ' A' ' 48' ' ' VAL . 1.6 mptm? -74.42 13.32 0.61 Allowed 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.251 -0.906 . . . . 0.0 112.321 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.527 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -52.66 -82.03 0.05 OUTLIER Glycine 0 N--CA 1.489 2.218 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.77 65.04 0.99 Allowed 'General case' 0 C--N 1.293 -1.89 0 CA-C-O 121.848 0.832 . . . . 0.0 109.97 -179.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.523 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -145.12 -69.35 0.02 OUTLIER Glycine 0 N--CA 1.486 2.031 0 N-CA-C 108.389 -1.885 . . . . 0.0 108.389 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.658 HG11 ' HB3' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -66.78 -46.82 84.61 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.949 0 O-C-N 122.344 -0.504 . . . . 0.0 111.864 -179.735 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -42.03 -59.37 1.77 Allowed 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.052 -1.03 . . . . 0.0 112.173 -177.526 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.681 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.1 p90 -80.54 -30.59 37.11 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.429 -1.419 . . . . 0.0 110.615 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.681 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -51.95 -54.22 32.06 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 120.523 -1.361 . . . . 0.0 108.671 178.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.512 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -55.35 -54.12 47.65 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-O 122.38 1.086 . . . . 0.0 110.246 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.8 mttt -64.15 -54.12 38.77 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.574 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.485 ' HA ' HD23 ' A' ' 54' ' ' LEU . 43.6 mt -50.56 -25.75 4.47 Favored 'General case' 0 C--N 1.31 -1.134 0 O-C-N 120.686 -1.259 . . . . 0.0 110.044 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 1.061 HG23 HG23 ' A' ' 57' ' ' ILE 0.344 0.3 OUTLIER -75.51 -64.24 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.815 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.786 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 62.76 43.03 99.56 Favored Glycine 0 N--CA 1.481 1.675 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 178.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.061 HG23 HG23 ' A' ' 55' ' ' ILE 0.254 3.1 pt -71.96 -117.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.284 -2.255 0 CA-C-O 122.512 1.148 . . . . 0.0 109.755 178.735 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.437 ' OXT' ' CG ' ' A' ' 58' ' ' ASP . 23.4 t70 . . . . . 0 C--N 1.258 -3.395 0 CA-C-O 117.948 -1.025 . . . . 0.0 109.989 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.484 ' O ' ' N ' ' A' ' 26' ' ' LYS . 4.7 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.348 0.594 . . . . 0.0 110.083 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 24' ' ' SER . 0.0 OUTLIER 65.51 -66.92 0.14 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.386 -0.821 . . . . 0.0 110.509 179.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -128.6 146.54 50.82 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.179 -0.951 . . . . 0.0 110.411 -179.804 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 26' ' ' LYS . 21.6 tt0 -179.06 -50.0 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.386 -0.821 . . . . 0.0 109.89 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -41.96 145.12 0.36 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.377 -0.827 . . . . 0.0 110.284 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 28' ' ' LYS . 38.0 ttpt -41.63 123.22 2.17 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.396 -0.815 . . . . 0.0 110.063 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 31' ' ' GLY . 6.5 mttt -39.56 111.28 0.18 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.522 -0.737 . . . . 0.0 110.776 -179.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -54.61 -161.56 0.01 OUTLIER Glycine 0 N--CA 1.484 1.872 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.422 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 41.3 Cg_endo -66.26 -173.17 0.33 Allowed 'Trans proline' 0 C--N 1.3 -1.987 0 O-C-N 124.109 1.584 . . . . 0.0 110.739 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.448 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.88 13.79 19.41 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 123.141 1.448 . . . . 0.0 109.841 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.576 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -64.12 153.29 38.12 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.702 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.703 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -159.64 -29.18 0.07 Allowed 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.154 -0.966 . . . . 0.0 111.705 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.488 ' HA ' HD22 ' A' ' 39' ' ' LEU . 1.5 t0 -93.43 -69.82 0.73 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.161 -0.962 . . . . 0.0 109.829 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.434 ' HB3' ' HE3' ' A' ' 34' ' ' LYS . 0.8 OUTLIER -64.19 -13.64 49.98 Favored 'General case' 0 C--N 1.287 -2.144 0 CA-C-O 121.902 0.858 . . . . 0.0 109.152 178.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.795 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -82.84 -17.83 42.54 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 121.308 0.575 . . . . 0.0 110.076 -179.816 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.604 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -47.72 -55.59 9.2 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.212 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.806 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -58.67 -33.55 70.25 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-O 121.963 0.887 . . . . 0.0 109.095 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.795 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -48.67 -43.05 36.5 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 120.978 -1.076 . . . . 0.0 108.299 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 44' ' ' LYS . 2.1 mmp_? -90.61 -16.58 28.42 Favored 'General case' 0 C--N 1.308 -1.2 0 O-C-N 121.733 -0.604 . . . . 0.0 111.591 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.806 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -42.35 -24.48 0.05 Allowed 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.157 -0.964 . . . . 0.0 110.793 -179.051 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.612 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -70.93 12.87 0.23 Allowed 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.092 -1.005 . . . . 0.0 112.897 -178.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -126.28 -104.09 1.37 Allowed Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.612 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 1.5 m-20 -82.15 35.63 0.44 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.374 -1.074 . . . . 0.0 110.819 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.604 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -89.82 -51.84 2.75 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 108.552 -1.819 . . . . 0.0 108.552 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.455 HG12 ' H ' ' A' ' 48' ' ' VAL . 0.2 OUTLIER -52.78 -45.87 50.35 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.081 0 CA-C-N 114.948 -0.626 . . . . 0.0 110.536 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HD2' ' O ' ' A' ' 46' ' ' ASP . 0.3 OUTLIER -43.84 -59.24 2.34 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 111.872 -178.255 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.675 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.4 p90 -89.3 -28.71 19.68 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.514 -1.366 . . . . 0.0 111.276 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.675 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -47.38 -55.78 8.21 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.698 -1.251 . . . . 0.0 109.225 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.505 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -51.94 -54.05 34.06 Favored 'General case' 0 C--N 1.284 -2.26 0 CA-C-O 122.505 1.145 . . . . 0.0 110.117 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 3.4 mttt -63.57 -53.1 56.98 Favored 'General case' 0 C--N 1.284 -2.275 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.719 -178.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 28.5 mt -50.29 -25.73 4.05 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 120.67 -1.269 . . . . 0.0 110.179 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 1.034 HG23 HG23 ' A' ' 57' ' ' ILE 0.339 0.3 OUTLIER -76.05 -65.76 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.864 0 CA-C-O 121.634 0.73 . . . . 0.0 109.142 178.831 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.785 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 56.96 41.7 92.24 Favored Glycine 0 N--CA 1.483 1.772 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 178.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.034 HG23 HG23 ' A' ' 55' ' ' ILE 0.252 3.3 pt -72.58 -118.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.283 -2.32 0 CA-C-O 122.575 1.179 . . . . 0.0 109.928 179.177 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.431 ' OD1' ' C ' ' A' ' 58' ' ' ASP . 16.2 t0 . . . . . 0 C--N 1.259 -3.354 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.22 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 121.272 0.558 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.9 -67.73 0.26 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.222 -0.924 . . . . 0.0 110.273 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 27' ' ' GLU . 6.2 ttmt 54.84 35.15 23.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.193 -0.942 . . . . 0.0 110.262 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -40.45 -30.45 0.11 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.419 -0.8 . . . . 0.0 110.665 -179.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.537 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -56.41 126.33 25.95 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.253 -0.904 . . . . 0.0 110.56 -179.734 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.537 ' C ' ' O ' ' A' ' 28' ' ' LYS . 6.9 ttmt 25.57 63.31 0.06 Allowed 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.331 0.586 . . . . 0.0 111.303 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.551 ' CG ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -63.77 60.66 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.5 -0.75 . . . . 0.0 111.244 -179.218 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 29' ' ' LYS . . . 49.04 -152.63 2.8 Favored Glycine 0 N--CA 1.485 1.908 0 C-N-CA 119.705 -1.236 . . . . 0.0 110.125 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 38.0 Cg_endo -63.45 -161.71 0.04 OUTLIER 'Trans proline' 0 C--N 1.3 -2.004 0 O-C-N 124.517 1.798 . . . . 0.0 111.602 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -79.32 2.38 21.69 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.909 1.338 . . . . 0.0 111.503 -178.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.55 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.251 0.1 OUTLIER -66.15 149.28 50.55 Favored 'General case' 0 C--N 1.26 -3.318 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.762 178.968 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.762 ' O ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -166.25 -24.87 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.557 0 O-C-N 120.993 -1.067 . . . . 0.0 112.226 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -97.2 -70.08 0.73 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.97 -1.081 . . . . 0.0 109.722 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.03 -13.12 57.11 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 121.914 0.864 . . . . 0.0 109.031 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.702 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -81.2 -19.11 43.98 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.113 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 35' ' ' THR . 0.2 OUTLIER -50.31 -56.64 10.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.009 -1.057 . . . . 0.0 109.406 179.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.812 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -63.33 -32.25 73.61 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.42 -37.45 5.11 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 120.877 -1.139 . . . . 0.0 108.883 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.29 -18.58 25.35 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.645 -0.659 . . . . 0.0 111.5 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.812 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -44.29 -33.79 1.72 Allowed 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.093 -1.004 . . . . 0.0 110.101 -179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.617 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 9.6 mptt -77.51 12.18 1.7 Allowed 'General case' 0 C--N 1.308 -1.201 0 O-C-N 121.163 -0.96 . . . . 0.0 112.079 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -115.05 -100.72 2.32 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.618 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 5.7 m-20 -82.24 33.13 0.39 Allowed 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.509 -0.995 . . . . 0.0 110.473 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.607 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -87.46 -51.89 3.17 Favored Glycine 0 N--CA 1.485 1.933 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.462 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -52.26 -46.78 45.52 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.193 0 CA-C-N 114.972 -0.614 . . . . 0.0 110.288 179.726 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 2.3 ptpt -43.09 -59.09 2.17 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.266 -0.896 . . . . 0.0 111.536 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.629 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 6.4 p90 -91.1 -26.36 19.16 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.518 -1.364 . . . . 0.0 111.128 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.629 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -47.92 -53.54 15.56 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.546 -1.346 . . . . 0.0 109.017 179.585 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.743 ' O ' HG23 ' A' ' 57' ' ' ILE . . . -55.98 -53.36 57.87 Favored 'General case' 0 C--N 1.285 -2.237 0 CA-C-O 122.584 1.183 . . . . 0.0 109.987 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' HA ' HG12 ' A' ' 57' ' ' ILE . 3.1 mtpm? -61.16 -54.03 49.58 Favored 'General case' 0 C--N 1.284 -2.259 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.514 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 26.5 mt -51.3 -27.06 8.46 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 120.687 -1.258 . . . . 0.0 110.542 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.703 HG22 ' N ' ' A' ' 56' ' ' GLY 0.326 0.2 OUTLIER -75.17 -57.63 6.06 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.434 0.635 . . . . 0.0 110.223 179.817 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.703 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 134.12 51.64 0.08 OUTLIER Glycine 0 C--N 1.302 -1.344 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.743 HG23 ' O ' ' A' ' 52' ' ' ALA 0.262 4.8 pt -74.68 -120.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.2 0 CA-C-O 122.649 1.214 . . . . 0.0 110.307 -179.912 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.434 ' C ' ' O ' ' A' ' 57' ' ' ILE . 48.6 t0 . . . . . 0 C--N 1.261 -3.24 0 CA-C-N 114.515 -1.22 . . . . 0.0 110.444 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.281 0.562 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.9 tmtp? 57.76 36.99 27.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.298 -0.876 . . . . 0.0 110.513 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.55 129.61 16.37 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.313 -0.867 . . . . 0.0 110.56 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 28' ' ' LYS . 3.2 mt-10 -53.95 -84.52 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.358 -0.839 . . . . 0.0 110.792 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.408 ' C ' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -42.13 134.08 2.88 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.287 -0.883 . . . . 0.0 111.031 -179.376 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.85 127.04 7.79 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 121.43 -0.794 . . . . 0.0 110.359 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.431 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -50.73 142.71 10.82 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.222 -0.924 . . . . 0.0 110.422 179.925 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 176.85 -172.59 45.55 Favored Glycine 0 N--CA 1.474 1.178 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -67.47 163.8 33.35 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.056 1.556 . . . . 0.0 111.167 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.9 9.93 28.44 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-O 123.038 1.399 . . . . 0.0 110.242 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.553 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -60.75 151.51 29.31 Favored 'General case' 0 C--N 1.267 -2.983 0 CA-C-N 114.156 -1.384 . . . . 0.0 109.844 179.298 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.698 ' O ' HD22 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -166.49 -23.15 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 O-C-N 120.987 -1.07 . . . . 0.0 112.563 -179.836 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -99.59 -70.07 0.74 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.76 -1.212 . . . . 0.0 109.868 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.89 -13.95 58.17 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-O 121.992 0.901 . . . . 0.0 108.774 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.691 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.5 -19.45 49.66 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.719 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.698 HD22 ' O ' ' A' ' 35' ' ' THR . 0.2 OUTLIER -48.92 -56.99 7.18 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.173 -0.954 . . . . 0.0 109.364 179.429 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.714 HD13 ' CG ' ' A' ' 43' ' ' PHE . 2.5 mm? -61.8 -32.35 72.64 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.666 0.746 . . . . 0.0 110.001 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -45.55 -36.92 4.95 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 120.943 -1.098 . . . . 0.0 108.814 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.3 OUTLIER -90.53 -19.83 23.34 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.627 -0.671 . . . . 0.0 111.644 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.714 ' CG ' HD13 ' A' ' 40' ' ' LEU . 1.2 m-85 -41.98 -41.8 2.62 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.214 -0.929 . . . . 0.0 110.45 -179.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.616 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.87 12.98 0.57 Allowed 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.019 -1.051 . . . . 0.0 112.364 -179.32 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -87.42 -99.81 0.87 Allowed Glycine 0 C--N 1.288 -2.096 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.636 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.6 m-20 -81.14 38.69 0.48 Allowed 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.529 -0.983 . . . . 0.0 110.817 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -100.51 -63.07 0.79 Allowed Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.424 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.1 OUTLIER -51.07 -43.16 25.92 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.124 0 CA-C-O 121.561 0.696 . . . . 0.0 110.395 179.678 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.636 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 2.4 ptpt -42.46 -59.55 1.83 Allowed 'General case' 0 C--N 1.296 -1.756 0 O-C-N 121.549 -0.72 . . . . 0.0 111.96 -178.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.659 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 2.6 p90 -86.25 -28.01 24.07 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.471 -1.393 . . . . 0.0 110.391 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.659 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 1.6 mmtp -55.16 -44.44 75.17 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 120.928 -1.107 . . . . 0.0 108.803 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.441 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -65.57 -55.07 19.67 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 122.308 1.051 . . . . 0.0 110.014 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -61.01 -54.13 48.65 Favored 'General case' 0 C--N 1.287 -2.143 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.231 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.496 ' HA ' HD23 ' A' ' 54' ' ' LEU . 44.9 mt -51.6 -29.4 17.27 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.816 -1.177 . . . . 0.0 110.26 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.884 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.335 0.3 OUTLIER -76.06 -57.67 5.77 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 CA-C-O 121.63 0.728 . . . . 0.0 109.857 179.58 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.704 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 105.65 50.57 0.9 Allowed Glycine 0 C--N 1.302 -1.324 0 N-CA-C 110.241 -1.143 . . . . 0.0 110.241 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.884 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.263 1.4 pt -76.93 -120.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.289 -2.064 0 CA-C-O 122.637 1.208 . . . . 0.0 110.127 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.535 ' H ' HD12 ' A' ' 57' ' ' ILE . 3.1 t70 . . . . . 0 C--N 1.259 -3.337 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.11 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.433 ' O ' ' N ' ' A' ' 26' ' ' LYS . 2.0 t . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 121.246 0.546 . . . . 0.0 110.188 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -51.45 92.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.877 . . . . 0.0 110.604 -179.798 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -57.35 -155.86 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.223 -0.923 . . . . 0.0 110.141 179.76 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.497 ' HG3' ' HB2' ' A' ' 29' ' ' LYS . 0.6 OUTLIER 177.28 88.46 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.23 -0.919 . . . . 0.0 110.485 179.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.54 ' HD3' ' N ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -67.67 -12.65 60.96 Favored 'General case' 0 C--N 1.306 -1.315 0 O-C-N 121.256 -0.902 . . . . 0.0 110.94 -179.858 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.497 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 16.3 mttt -44.22 110.95 0.25 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.09 -1.006 . . . . 0.0 110.459 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 31' ' ' GLY . 6.5 mttp -53.99 -167.83 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.367 -0.833 . . . . 0.0 110.477 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -53.28 -167.3 0.02 OUTLIER Glycine 0 N--CA 1.485 1.935 0 N-CA-C 110.244 -1.143 . . . . 0.0 110.244 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -66.82 155.02 72.51 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 O-C-N 124.106 1.582 . . . . 0.0 111.036 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.433 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -88.92 7.46 34.37 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 123.01 1.386 . . . . 0.0 110.368 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.531 ' CD ' ' HB3' ' A' ' 38' ' ' TYR 0.256 0.2 OUTLIER -69.7 159.97 32.52 Favored 'General case' 0 C--N 1.266 -3.062 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.191 179.641 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.704 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -167.88 -28.64 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 O-C-N 120.922 -1.111 . . . . 0.0 111.803 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 8.9 t70 -94.78 -70.25 0.72 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.063 -1.023 . . . . 0.0 109.97 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -63.52 -14.47 51.44 Favored 'General case' 0 C--N 1.283 -2.301 0 CA-C-O 122.041 0.924 . . . . 0.0 109.091 178.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.704 ' CD1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -82.04 -18.15 44.24 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.088 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -46.16 -57.11 4.8 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.353 -0.842 . . . . 0.0 109.46 179.074 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.641 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.3 mm? -61.13 -37.93 84.57 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.565 -0.709 . . . . 0.0 109.876 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.671 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.72 -35.48 1.85 Allowed 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.053 -1.029 . . . . 0.0 108.746 178.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' A' ' 43' ' ' PHE . 24.7 mtp180 -91.71 -17.62 25.18 Favored 'General case' 0 C--N 1.307 -1.253 0 O-C-N 121.822 -0.549 . . . . 0.0 112.079 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.659 ' O ' HG12 ' A' ' 48' ' ' VAL . 0.8 OUTLIER -40.12 -61.67 0.85 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.156 -0.965 . . . . 0.0 111.027 -178.465 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.62 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 1.1 mptm? -77.48 13.77 1.15 Allowed 'General case' 0 C--N 1.309 -1.168 0 O-C-N 121.143 -0.973 . . . . 0.0 112.498 -179.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.468 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -91.94 -100.54 1.34 Allowed Glycine 0 C--N 1.287 -2.167 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.51 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -106.9 62.71 0.63 Allowed 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.794 -0.827 . . . . 0.0 109.733 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.545 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -145.58 -83.02 0.05 OUTLIER Glycine 0 N--CA 1.485 1.937 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.659 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.2 OUTLIER -50.92 -46.1 29.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 121.985 -0.714 . . . . 0.0 110.848 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HD2' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -42.15 -59.21 1.85 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.525 -0.734 . . . . 0.0 111.947 -177.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.691 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.1 p90 -91.26 -27.61 18.32 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 120.363 -1.46 . . . . 0.0 111.019 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.691 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.1 OUTLIER -46.59 -56.82 5.46 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.664 -1.272 . . . . 0.0 109.67 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.521 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -52.75 -54.24 36.7 Favored 'General case' 0 C--N 1.283 -2.304 0 CA-C-O 122.399 1.095 . . . . 0.0 110.66 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.4 mttm -65.78 -52.55 49.92 Favored 'General case' 0 C--N 1.283 -2.292 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.92 -178.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.599 HD12 ' CD1' ' A' ' 50' ' ' TYR . 30.4 mt -50.87 -22.88 2.42 Favored 'General case' 0 C--N 1.308 -1.214 0 O-C-N 120.709 -1.245 . . . . 0.0 110.792 -179.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.785 HG22 HG23 ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -75.31 -57.88 5.58 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.885 0 CA-C-O 121.539 0.685 . . . . 0.0 109.535 179.642 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.684 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 124.27 43.6 0.32 Allowed Glycine 0 N--CA 1.475 1.25 0 C-N-CA 120.077 -1.059 . . . . 0.0 110.864 179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.785 HG23 HG22 ' A' ' 55' ' ' ILE 0.268 1.7 pt -83.88 -123.68 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.235 0 CA-C-O 122.676 1.227 . . . . 0.0 109.944 179.361 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.488 ' H ' HD12 ' A' ' 57' ' ' ILE . 6.3 t0 . . . . . 0 C--N 1.261 -3.274 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.447 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.349 0.595 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -44.46 116.9 1.13 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.404 -0.81 . . . . 0.0 110.724 -179.664 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.471 ' O ' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -68.85 59.16 0.09 Allowed 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.263 -0.898 . . . . 0.0 110.497 179.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.477 ' O ' ' N ' ' A' ' 29' ' ' LYS . 4.1 tp10 56.15 157.2 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.345 -0.847 . . . . 0.0 110.607 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -47.84 91.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.301 -0.874 . . . . 0.0 110.737 -179.752 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.477 ' N ' ' O ' ' A' ' 27' ' ' GLU . 2.8 ttmt -44.47 138.56 3.17 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.112 -0.993 . . . . 0.0 109.998 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.408 ' O ' ' O ' ' A' ' 31' ' ' GLY . 14.0 mtmt -49.54 165.12 0.07 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.231 -0.918 . . . . 0.0 110.731 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.408 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 45.9 -169.39 0.03 OUTLIER Glycine 0 N--CA 1.488 2.137 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.9 163.22 36.44 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.165 1.613 . . . . 0.0 110.859 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.441 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -94.03 6.88 47.11 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 122.918 1.342 . . . . 0.0 110.532 -179.562 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.557 ' HD2' ' CB ' ' A' ' 38' ' ' TYR 0.252 0.0 OUTLIER -75.96 142.89 41.86 Favored 'General case' 0 C--N 1.264 -3.149 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.588 179.918 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.618 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -169.05 -25.32 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.267 -0.896 . . . . 0.0 111.618 179.529 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.05 -70.38 0.74 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.98 -1.075 . . . . 0.0 109.419 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.428 ' HB2' ' NZ ' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -65.47 -13.56 59.06 Favored 'General case' 0 C--N 1.283 -2.309 0 CA-C-O 122.038 0.923 . . . . 0.0 108.545 178.118 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.633 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.12 -19.9 56.36 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.131 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -50.87 -56.53 11.81 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.28 -0.887 . . . . 0.0 109.357 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.762 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -61.73 -35.17 77.3 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.65 -0.656 . . . . 0.0 110.116 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -43.14 -36.9 1.84 Allowed 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.054 -1.029 . . . . 0.0 109.009 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.4 mtp180 -90.69 -19.57 23.45 Favored 'General case' 0 C--N 1.307 -1.244 0 O-C-N 121.627 -0.67 . . . . 0.0 111.806 -179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.762 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.6 m-85 -42.24 -48.88 5.0 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.142 -0.974 . . . . 0.0 110.627 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.615 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.2 mptp? -73.62 13.42 0.48 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.17 -0.957 . . . . 0.0 112.822 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.89 -12.77 48.87 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.547 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -86.4 49.15 1.74 Allowed 'General case' 0 C--N 1.287 -2.122 0 O-C-N 121.766 -0.844 . . . . 0.0 110.116 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -112.8 -73.8 0.65 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.498 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -51.74 -40.28 26.41 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.938 0 CA-C-O 121.628 0.727 . . . . 0.0 110.625 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.496 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 3.2 ptpt -41.04 -59.55 1.44 Allowed 'General case' 0 C--N 1.295 -1.795 0 O-C-N 121.728 -0.607 . . . . 0.0 112.128 -177.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.653 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 3.4 p90 -92.5 -28.38 16.84 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 120.338 -1.476 . . . . 0.0 111.125 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.653 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -58.79 -40.66 84.66 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 120.603 -1.311 . . . . 0.0 109.42 179.589 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.475 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -71.48 -54.71 9.7 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-O 122.395 1.093 . . . . 0.0 110.332 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.6 mttt -60.96 -53.13 61.01 Favored 'General case' 0 C--N 1.285 -2.238 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.877 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 52.7 mt -51.14 -28.24 10.45 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.94 -1.1 . . . . 0.0 110.567 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.89 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.332 0.3 OUTLIER -75.9 -57.19 6.6 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.843 0 CA-C-O 121.629 0.728 . . . . 0.0 109.895 179.771 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.684 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 101.89 51.85 1.06 Allowed Glycine 0 C--N 1.302 -1.323 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.89 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.259 4.4 pt -74.06 -120.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.208 0 CA-C-O 122.654 1.216 . . . . 0.0 110.316 179.838 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.43 ' OD1' ' O ' ' A' ' 58' ' ' ASP . 46.6 t0 . . . . . 0 C--N 1.259 -3.327 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.395 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.409 ' O ' ' C ' ' A' ' 25' ' ' LYS . 75.4 m . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 121.292 0.568 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.409 ' C ' ' O ' ' A' ' 24' ' ' SER . 31.1 mtpt -42.79 152.16 0.11 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 0.0 110.468 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.402 ' O ' ' HG2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -54.78 135.94 46.92 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.302 -0.874 . . . . 0.0 110.91 -179.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.79 108.09 0.32 Allowed 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.3 -0.875 . . . . 0.0 110.556 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.97 96.85 0.15 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.117 -0.989 . . . . 0.0 110.474 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 tttt -47.14 151.4 0.68 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.259 -0.901 . . . . 0.0 110.596 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.458 ' O ' ' O ' ' A' ' 31' ' ' GLY . 16.0 mttp -75.62 99.59 4.35 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.248 -0.907 . . . . 0.0 110.506 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -43.6 167.09 0.02 OUTLIER Glycine 0 N--CA 1.487 2.034 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -71.04 146.53 52.54 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 O-C-N 124.232 1.648 . . . . 0.0 110.927 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -98.81 7.52 45.97 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 123.166 1.46 . . . . 0.0 110.201 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.568 ' HD2' ' CB ' ' A' ' 38' ' ' TYR . 1.7 mmtp -69.37 153.6 43.33 Favored 'General case' 0 C--N 1.265 -3.086 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.596 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.668 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -165.66 -24.65 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.139 -0.976 . . . . 0.0 112.113 179.719 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 23.3 t0 -101.37 -69.76 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.717 -1.239 . . . . 0.0 109.276 179.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.2 -14.88 54.13 Favored 'General case' 0 C--N 1.282 -2.347 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 178.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.698 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.17 -19.54 50.68 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.654 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.69 -56.41 4.45 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.158 -0.964 . . . . 0.0 109.424 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.778 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.6 mm? -59.33 -32.39 70.05 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.848 0.832 . . . . 0.0 109.456 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.698 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -57.61 -41.48 81.37 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.497 ' O ' ' N ' ' A' ' 44' ' ' LYS . 16.3 mmt180 -90.18 -16.7 28.96 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.435 0.636 . . . . 0.0 111.205 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.778 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -39.77 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.474 -0.766 . . . . 0.0 111.318 -179.033 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.597 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.7 OUTLIER -74.1 12.83 0.64 Allowed 'General case' 0 C--N 1.309 -1.171 0 O-C-N 120.85 -1.156 . . . . 0.0 112.378 -179.198 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.519 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -42.65 -69.87 0.56 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.5 59.87 0.06 Allowed 'General case' 0 C--N 1.288 -2.085 0 CA-C-O 121.86 0.838 . . . . 0.0 109.422 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 45' ' ' GLY . . . -140.23 -78.74 0.06 OUTLIER Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.316 -1.514 . . . . 0.0 109.316 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.475 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -62.99 -44.12 99.48 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.771 0 O-C-N 121.943 -0.74 . . . . 0.0 111.592 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -40.65 -58.87 1.51 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.208 -0.932 . . . . 0.0 111.966 -177.616 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.656 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 4.6 p90 -83.09 -28.15 29.71 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.385 -1.447 . . . . 0.0 110.77 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.656 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -61.07 -42.08 97.82 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.505 -1.372 . . . . 0.0 108.756 179.249 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.495 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -71.5 -54.99 8.75 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-O 122.414 1.102 . . . . 0.0 110.188 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -58.9 -53.71 55.36 Favored 'General case' 0 C--N 1.286 -2.177 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.862 -179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 58.5 mt -50.29 -30.96 13.04 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 120.837 -1.164 . . . . 0.0 109.786 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 1.038 HG23 HG23 ' A' ' 57' ' ' ILE 0.347 0.3 OUTLIER -75.94 -65.05 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.259 179.131 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.782 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 61.65 41.08 99.53 Favored Glycine 0 N--CA 1.481 1.689 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.038 HG23 HG23 ' A' ' 55' ' ' ILE 0.254 4.8 pt -75.43 -120.59 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.284 -2.26 0 CA-C-O 122.656 1.217 . . . . 0.0 109.796 178.816 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.405 ' N ' ' CG1' ' A' ' 57' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--N 1.26 -3.292 0 CA-C-N 114.592 -1.186 . . . . 0.0 110.47 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.434 ' O ' ' C ' ' A' ' 25' ' ' LYS . 9.7 t . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.104 0.478 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -41.96 150.49 0.12 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 -179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 25' ' ' LYS . 34.5 ttmt 179.48 -49.8 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.358 -0.839 . . . . 0.0 110.035 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.5 ' O ' ' N ' ' A' ' 29' ' ' LYS . 31.0 tt0 40.53 86.27 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.509 -0.745 . . . . 0.0 110.286 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 30' ' ' LYS . 3.0 ttpm? 33.45 -92.62 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.876 -0.515 . . . . 0.0 111.162 179.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -49.04 91.7 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.883 -1.136 . . . . 0.0 110.601 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.535 ' CG ' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -59.78 103.16 0.19 Allowed 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.255 -0.903 . . . . 0.0 111.4 -179.609 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 40.21 -163.63 0.01 OUTLIER Glycine 0 N--CA 1.491 2.342 0 N-CA-C 110.704 -0.958 . . . . 0.0 110.704 179.096 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.55 -169.02 0.2 Allowed 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.324 1.697 . . . . 0.0 111.214 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.51 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -87.24 4.53 42.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-O 123.161 1.457 . . . . 0.0 110.526 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.264 0.1 OUTLIER -70.13 160.7 31.57 Favored 'General case' 0 C--N 1.264 -3.142 0 CA-C-N 113.975 -1.466 . . . . 0.0 110.424 179.53 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.634 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -167.28 -22.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.645 -1.284 . . . . 0.0 112.63 179.725 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.0 -70.3 0.77 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.685 -1.26 . . . . 0.0 109.606 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.13 -14.54 49.79 Favored 'General case' 0 C--N 1.282 -2.335 0 CA-C-O 122.076 0.941 . . . . 0.0 108.647 178.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.736 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.18 -19.0 52.0 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.677 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.615 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.83 -56.44 6.28 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.112 -0.992 . . . . 0.0 109.704 179.675 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.77 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.2 mm? -63.41 -23.64 67.49 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-O 121.824 0.821 . . . . 0.0 109.885 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.736 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -56.78 -40.84 76.61 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.041 -1.037 . . . . 0.0 108.844 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 43' ' ' PHE . 10.7 mmt-85 -89.84 -17.41 28.16 Favored 'General case' 0 C--N 1.307 -1.256 0 O-C-N 121.687 -0.633 . . . . 0.0 111.505 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.77 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -39.47 -36.93 0.42 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.399 -0.813 . . . . 0.0 110.735 -179.297 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 2.7 mptt -76.09 13.8 0.82 Allowed 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.171 -0.956 . . . . 0.0 112.638 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.416 ' N ' ' O ' ' A' ' 42' ' ' ARG . . . -127.85 -72.86 0.17 Allowed Glycine 0 N--CA 1.49 2.268 0 C-N-CA 120.115 -1.041 . . . . 0.0 110.526 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.629 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -75.71 39.56 0.17 Allowed 'General case' 0 C--N 1.289 -2.045 0 O-C-N 121.879 -0.777 . . . . 0.0 111.342 -178.94 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -98.68 -62.03 0.86 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.453 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -51.17 -43.73 28.11 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 CA-C-O 121.613 0.721 . . . . 0.0 110.51 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.629 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 2.8 ptpt -42.18 -59.8 1.67 Allowed 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.516 -0.74 . . . . 0.0 112.182 -178.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.73 ' HD1' HD12 ' A' ' 54' ' ' LEU . 3.9 p90 -90.12 -27.53 19.56 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 120.472 -1.392 . . . . 0.0 110.585 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.658 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -48.59 -52.78 21.19 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 120.777 -1.202 . . . . 0.0 109.21 179.483 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.52 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -60.11 -53.67 55.05 Favored 'General case' 0 C--N 1.285 -2.224 0 CA-C-O 122.467 1.127 . . . . 0.0 110.396 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -62.93 -52.58 62.51 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.722 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.73 HD12 ' HD1' ' A' ' 50' ' ' TYR . 40.8 mt -51.38 -24.67 5.03 Favored 'General case' 0 C--N 1.306 -1.319 0 O-C-N 120.787 -1.196 . . . . 0.0 110.833 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.696 HG22 ' N ' ' A' ' 56' ' ' GLY 0.329 0.3 OUTLIER -75.37 -56.73 7.87 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 CA-C-O 121.604 0.716 . . . . 0.0 109.832 179.537 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.696 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 122.2 46.55 0.3 Allowed Glycine 0 C--N 1.302 -1.332 0 N-CA-C 110.285 -1.126 . . . . 0.0 110.285 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.645 HG23 HG22 ' A' ' 55' ' ' ILE 0.261 1.3 pt -76.73 -119.82 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.159 0 CA-C-O 122.571 1.177 . . . . 0.0 110.424 179.876 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.576 ' H ' HD12 ' A' ' 57' ' ' ILE . 33.3 t70 . . . . . 0 C--N 1.26 -3.291 0 CA-C-N 114.812 -1.086 . . . . 0.0 110.41 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 121.308 0.575 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -59.98 -11.08 4.94 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.366 -0.834 . . . . 0.0 110.654 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.48 145.6 14.64 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 121.109 -0.994 . . . . 0.0 110.426 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -45.65 -25.46 0.47 Allowed 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.304 -0.872 . . . . 0.0 110.688 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.499 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -55.41 -17.21 4.58 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.207 -0.933 . . . . 0.0 110.798 -179.552 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.499 ' C ' ' O ' ' A' ' 28' ' ' LYS . 0.5 OUTLIER 27.58 68.22 0.07 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 121.378 0.609 . . . . 0.0 111.41 179.554 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.464 ' O ' ' O ' ' A' ' 31' ' ' GLY . 7.7 mmtp -53.83 129.52 33.91 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.281 -0.887 . . . . 0.0 110.803 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.464 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 46.08 -175.29 0.01 OUTLIER Glycine 0 N--CA 1.487 2.042 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.5 Cg_endo -68.34 -166.05 0.14 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 124.249 1.657 . . . . 0.0 111.688 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.443 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -85.74 5.39 32.5 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 123.027 1.394 . . . . 0.0 110.879 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.619 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.261 0.0 OUTLIER -66.43 164.52 16.13 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 114.055 -1.43 . . . . 0.0 110.655 179.912 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.656 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 1.3 m -166.16 -22.12 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.938 -1.102 . . . . 0.0 112.733 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.7 OUTLIER -103.22 -70.65 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 120.552 -1.343 . . . . 0.0 109.81 179.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.472 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 19.7 mt-10 -63.5 -15.11 56.92 Favored 'General case' 0 C--N 1.284 -2.276 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.776 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.73 -19.11 55.75 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.306 -179.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.591 HD22 ' CE1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -44.33 -55.67 4.77 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.779 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.826 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.6 mm? -60.53 -26.67 67.05 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.85 0.833 . . . . 0.0 109.384 178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.776 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -58.7 -41.03 85.35 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.05 -1.031 . . . . 0.0 108.224 178.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 44' ' ' LYS . 7.2 mmm-85 -89.73 -16.22 30.81 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.393 0.616 . . . . 0.0 110.82 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.826 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -42.04 -25.08 0.06 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.382 -0.824 . . . . 0.0 110.337 -179.644 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.611 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 4.6 mptp? -72.45 12.97 0.39 Allowed 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.217 -0.927 . . . . 0.0 112.871 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -89.65 -101.63 1.09 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 108.663 -1.775 . . . . 0.0 108.663 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.643 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -85.91 33.77 0.6 Allowed 'General case' 0 C--N 1.296 -1.721 0 O-C-N 121.554 -0.968 . . . . 0.0 109.938 179.394 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.476 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -97.72 -64.93 0.89 Allowed Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.448 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -49.21 -43.42 16.2 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 CA-C-O 121.429 0.633 . . . . 0.0 110.477 179.877 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.583 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -42.11 -59.64 1.7 Allowed 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.446 -0.784 . . . . 0.0 111.676 -178.08 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.652 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 3.1 p90 -88.97 -26.47 21.48 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.43 -1.419 . . . . 0.0 110.489 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.652 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -53.97 -42.6 69.12 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 120.932 -1.105 . . . . 0.0 108.975 179.646 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.504 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -59.78 -54.28 48.11 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-O 122.431 1.11 . . . . 0.0 109.829 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -68.7 -53.06 24.45 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.534 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.623 HD12 ' CD1' ' A' ' 50' ' ' TYR . 30.3 mt -50.7 -22.5 2.11 Favored 'General case' 0 C--N 1.308 -1.196 0 O-C-N 120.751 -1.218 . . . . 0.0 110.399 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 1.008 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.341 0.3 OUTLIER -75.5 -61.2 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.827 0 CA-C-O 121.644 0.735 . . . . 0.0 109.222 179.265 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.749 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 73.95 50.29 11.25 Favored Glycine 0 N--CA 1.483 1.806 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.181 177.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.008 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.253 3.1 pt -72.43 -117.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.151 0 CA-C-O 122.597 1.189 . . . . 0.0 109.978 178.394 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 t70 . . . . . 0 C--N 1.26 -3.291 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.155 179.682 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.478 ' O ' ' N ' ' A' ' 26' ' ' LYS . 39.7 t . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.247 0.546 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' O ' ' O ' ' A' ' 26' ' ' LYS . 5.2 mtmp? -66.44 59.13 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.385 -0.822 . . . . 0.0 110.547 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.518 ' O ' ' N ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -54.6 -164.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.259 -0.901 . . . . 0.0 110.338 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.44 ' O ' ' C ' ' A' ' 28' ' ' LYS . 2.0 tt0 45.66 -91.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.341 -0.849 . . . . 0.0 110.154 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.546 ' O ' ' C ' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -41.29 119.4 1.2 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.282 -0.886 . . . . 0.0 109.865 179.768 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.546 ' C ' ' O ' ' A' ' 28' ' ' LYS . 4.9 ttmt -15.92 83.34 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.276 0 CA-C-O 121.481 0.657 . . . . 0.0 111.938 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -51.07 130.09 25.23 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.396 -0.815 . . . . 0.0 110.945 -179.445 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.461 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 40.59 -162.77 0.01 OUTLIER Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.4 169.0 18.0 Favored 'Trans proline' 0 C--N 1.302 -1.884 0 O-C-N 124.187 1.625 . . . . 0.0 110.939 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.513 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -92.83 8.84 37.83 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 123.16 1.457 . . . . 0.0 110.235 -179.548 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.478 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.257 0.0 OUTLIER -62.01 157.64 18.27 Favored 'General case' 0 C--N 1.268 -2.958 0 CA-C-N 113.995 -1.457 . . . . 0.0 110.26 179.532 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.666 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.1 -23.73 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.748 -1.22 . . . . 0.0 112.716 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t0 -101.5 -70.33 0.75 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.717 -1.239 . . . . 0.0 109.881 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.13 -14.74 52.17 Favored 'General case' 0 C--N 1.282 -2.348 0 CA-C-O 122.031 0.92 . . . . 0.0 108.572 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.691 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -79.85 -19.16 49.0 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.482 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -44.09 -56.2 4.2 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.327 -0.858 . . . . 0.0 109.567 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.881 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.5 mm? -64.91 -32.02 73.53 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.651 -0.656 . . . . 0.0 110.076 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.691 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -42.98 -33.1 0.74 Allowed 'General case' 0 C--N 1.298 -1.663 0 O-C-N 121.045 -1.034 . . . . 0.0 109.085 178.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -90.71 -17.35 26.91 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-O 121.346 0.594 . . . . 0.0 111.427 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.881 ' CD2' HD13 ' A' ' 40' ' ' LEU . 2.8 m-85 -55.49 -11.98 1.01 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.312 -0.868 . . . . 0.0 111.241 -179.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.596 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 3.8 mptt -70.53 13.54 0.17 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.049 -1.032 . . . . 0.0 113.207 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.84 -90.21 0.02 OUTLIER Glycine 0 N--CA 1.488 2.119 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.609 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 1.6 m-20 -85.67 30.02 0.67 Allowed 'General case' 0 C--N 1.293 -1.883 0 O-C-N 121.874 -0.78 . . . . 0.0 110.521 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.561 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -88.28 -54.53 2.4 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.467 ' H ' HG12 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -49.48 -46.17 19.88 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.245 0 CA-C-O 121.373 0.606 . . . . 0.0 110.381 179.66 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.533 ' HG2' ' HA ' ' A' ' 46' ' ' ASP . 0.1 OUTLIER -44.48 -59.43 2.44 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.419 -0.8 . . . . 0.0 111.804 -178.128 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.656 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.0 p90 -90.22 -28.65 18.72 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 120.542 -1.349 . . . . 0.0 111.649 -179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.656 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 2.1 mmtm -53.44 -45.79 69.6 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 120.533 -1.354 . . . . 0.0 109.279 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.462 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -66.59 -55.07 17.07 Favored 'General case' 0 C--N 1.287 -2.141 0 CA-C-O 122.307 1.051 . . . . 0.0 109.841 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.407 ' HB2' ' HA ' ' A' ' 50' ' ' TYR . 22.1 mttt -56.45 -54.66 43.09 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.533 -179.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 39.5 mt -51.49 -30.05 18.71 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 120.811 -1.181 . . . . 0.0 109.773 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 1.001 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.344 0.3 OUTLIER -81.37 -62.84 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.993 179.848 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.756 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 72.31 50.02 18.19 Favored Glycine 0 N--CA 1.481 1.654 0 O-C-N 121.529 -0.732 . . . . 0.0 111.986 178.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.001 HG23 ' CG2' ' A' ' 55' ' ' ILE . 4.2 pt -72.38 -117.73 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 CA-C-O 122.661 1.219 . . . . 0.0 109.932 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.409 ' H ' ' CG1' ' A' ' 57' ' ' ILE . 16.1 t0 . . . . . 0 C--N 1.26 -3.307 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.066 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 121.164 0.507 . . . . 0.0 110.135 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 24' ' ' SER . 5.7 tttp -177.09 93.42 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.289 -0.882 . . . . 0.0 110.354 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.442 ' O ' ' N ' ' A' ' 28' ' ' LYS . 2.7 tttt 54.47 67.47 1.01 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.478 -0.764 . . . . 0.0 110.558 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 26' ' ' LYS . 2.9 tt0 -42.0 -26.62 0.1 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.277 -0.889 . . . . 0.0 110.253 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 29' ' ' LYS . 6.6 tptt -56.79 -14.2 3.19 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.182 -0.949 . . . . 0.0 110.547 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.495 ' O ' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -48.16 -177.98 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.368 -0.832 . . . . 0.0 110.613 -179.63 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.461 ' O ' ' O ' ' A' ' 31' ' ' GLY . 3.5 mttm -39.38 100.73 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.381 -0.824 . . . . 0.0 110.671 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.461 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . 52.57 170.2 0.02 OUTLIER Glycine 0 N--CA 1.486 1.971 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -70.47 176.13 7.74 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 124.136 1.598 . . . . 0.0 110.928 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.45 ' CD ' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -90.6 8.91 31.83 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.214 1.483 . . . . 0.0 110.047 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.63 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.268 0.4 OUTLIER -70.66 -178.81 1.93 Allowed 'General case' 0 C--N 1.266 -3.022 0 CA-C-N 113.728 -1.578 . . . . 0.0 110.772 179.784 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.661 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -166.63 -18.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.774 -1.204 . . . . 0.0 113.574 179.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.495 ' HA ' HD23 ' A' ' 39' ' ' LEU . 32.5 t70 -106.67 -70.97 0.77 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.384 -1.447 . . . . 0.0 110.506 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.506 ' HB2' ' HE3' ' A' ' 34' ' ' LYS . 6.4 mt-10 -63.25 -14.25 47.33 Favored 'General case' 0 C--N 1.283 -2.299 0 CA-C-O 122.25 1.024 . . . . 0.0 108.388 178.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.661 ' CE1' ' HA ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -79.37 -18.51 52.24 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.405 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER -44.35 -57.0 3.77 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.169 179.725 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.68 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.1 mm? -61.46 -37.49 83.77 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.554 -0.716 . . . . 0.0 109.508 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.633 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -47.41 -33.05 5.56 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.677 -1.265 . . . . 0.0 108.006 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.403 ' O ' ' N ' ' A' ' 45' ' ' GLY . 0.0 OUTLIER -90.79 -20.19 22.63 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.916 -0.49 . . . . 0.0 111.347 179.79 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.68 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -43.18 -45.86 5.75 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.22 -0.925 . . . . 0.0 109.728 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.646 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 8.4 mptt -78.53 13.13 1.7 Allowed 'General case' 0 C--N 1.308 -1.237 0 O-C-N 121.333 -0.854 . . . . 0.0 111.83 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.509 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -74.2 -91.35 0.15 Allowed Glycine 0 N--CA 1.489 2.179 0 N-CA-C 110.396 -1.081 . . . . 0.0 110.396 -179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.401 ' HA ' ' CD ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -99.42 61.94 1.21 Allowed 'General case' 0 C--N 1.295 -1.767 0 O-C-N 121.695 -0.885 . . . . 0.0 109.705 -179.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.489 ' HA2' ' OH ' ' A' ' 50' ' ' TYR . . . -139.8 -72.31 0.04 OUTLIER Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.669 -1.773 . . . . 0.0 108.669 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -45.4 98.95 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.896 0 CA-C-O 121.386 0.612 . . . . 0.0 111.982 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 45' ' ' GLY . 0.2 OUTLIER -42.21 -60.29 1.51 Allowed 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.28 -0.887 . . . . 0.0 112.612 -177.078 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.679 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 10.5 p90 -82.93 -33.45 26.8 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.184 -1.573 . . . . 0.0 111.208 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.679 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -49.16 -56.63 8.6 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.683 -1.261 . . . . 0.0 109.252 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.473 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -50.18 -54.66 19.31 Favored 'General case' 0 C--N 1.284 -2.255 0 CA-C-O 122.336 1.065 . . . . 0.0 110.56 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -67.08 -53.66 28.79 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.496 -178.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 33.0 mt -51.15 -24.03 3.8 Favored 'General case' 0 C--N 1.307 -1.255 0 O-C-N 120.768 -1.208 . . . . 0.0 110.437 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 1.064 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.336 0.3 OUTLIER -75.51 -58.72 4.12 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.783 0 CA-C-O 121.633 0.73 . . . . 0.0 109.512 179.627 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.717 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 87.24 51.3 3.37 Favored Glycine 0 N--CA 1.48 1.614 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.806 178.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.064 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.255 4.0 pt -73.75 -119.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.157 0 CA-C-O 122.743 1.259 . . . . 0.0 109.964 178.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.3 t0 . . . . . 0 C--N 1.261 -3.247 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.401 -179.795 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.217 0.532 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.5 -24.95 0.95 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.307 -0.871 . . . . 0.0 110.377 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.444 ' O ' ' HB3' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -47.08 -76.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.272 -0.893 . . . . 0.0 110.521 -179.868 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.444 ' HB3' ' O ' ' A' ' 26' ' ' LYS . 3.2 tp10 61.22 117.55 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.318 -0.864 . . . . 0.0 110.036 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -44.2 110.36 0.21 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.34 -0.85 . . . . 0.0 110.749 -179.835 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.62 78.3 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.406 -0.809 . . . . 0.0 110.556 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 28' ' ' LYS . 12.0 ptmm? -48.42 132.81 16.66 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.168 -0.957 . . . . 0.0 110.967 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.443 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -46.33 172.01 0.02 OUTLIER Glycine 0 N--CA 1.487 2.048 0 N-CA-C 109.9 -1.28 . . . . 0.0 109.9 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.21 149.55 64.2 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 O-C-N 123.984 1.518 . . . . 0.0 111.11 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -99.36 10.29 41.68 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 123.271 1.51 . . . . 0.0 109.843 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.594 ' CD ' ' HB2' ' A' ' 38' ' ' TYR 0.266 0.1 OUTLIER -81.64 91.25 6.39 Favored 'General case' 0 C--N 1.267 -3.017 0 CA-C-N 113.798 -1.546 . . . . 0.0 110.177 179.824 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.641 ' CA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -154.5 -30.72 0.11 Allowed 'General case' 0 C--N 1.291 -1.96 0 O-C-N 121.642 -0.661 . . . . 0.0 110.569 -179.792 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 2.9 t0 -107.19 -68.72 0.88 Allowed 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.06 -13.39 59.91 Favored 'General case' 0 C--N 1.284 -2.278 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.654 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -80.33 -19.89 45.49 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.202 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -46.58 -56.53 5.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.199 -0.938 . . . . 0.0 109.415 179.166 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.88 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.1 mm? -60.78 -35.58 76.8 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.739 0.78 . . . . 0.0 109.839 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -46.85 -38.97 11.14 Favored 'General case' 0 C--N 1.297 -1.701 0 O-C-N 120.847 -1.158 . . . . 0.0 108.555 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -90.82 -17.46 26.55 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 121.715 -0.616 . . . . 0.0 111.722 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.88 ' CD2' HD13 ' A' ' 40' ' ' LEU . 1.3 m-85 -44.66 -40.01 5.53 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 110.977 -178.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.6 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -68.76 14.55 0.07 Allowed 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 -178.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.47 -103.35 2.84 Favored Glycine 0 C--N 1.288 -2.137 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.024 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.42 ' O ' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -107.91 65.73 0.64 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.904 0.859 . . . . 0.0 109.956 -179.358 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.546 ' HA2' ' CZ ' ' A' ' 50' ' ' TYR . . . -142.68 -75.84 0.04 OUTLIER Glycine 0 N--CA 1.485 1.905 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 179.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.634 HG12 ' O ' ' A' ' 43' ' ' PHE . 0.3 OUTLIER -56.82 -46.59 83.47 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 CA-C-O 121.398 0.618 . . . . 0.0 111.283 179.834 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.563 ' HE3' ' N ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -41.85 -59.94 1.54 Allowed 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.36 -0.838 . . . . 0.0 112.032 -177.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.678 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 5.4 p90 -87.51 -27.83 22.4 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.261 -1.524 . . . . 0.0 111.362 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.678 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.3 OUTLIER -52.2 -52.47 52.0 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.589 -1.32 . . . . 0.0 109.054 179.793 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.493 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -54.41 -54.01 46.37 Favored 'General case' 0 C--N 1.285 -2.237 0 CA-C-O 122.413 1.102 . . . . 0.0 110.422 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -66.1 -53.85 32.92 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.817 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 31.5 mt -51.15 -23.31 3.16 Favored 'General case' 0 C--N 1.308 -1.223 0 O-C-N 120.755 -1.216 . . . . 0.0 110.606 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.845 ' CG2' HG23 ' A' ' 57' ' ' ILE 0.331 0.3 OUTLIER -75.76 -57.46 6.19 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.91 0 CA-C-O 121.604 0.716 . . . . 0.0 110.056 179.778 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.705 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 113.93 46.22 0.66 Allowed Glycine 0 C--N 1.301 -1.379 0 N-CA-C 110.081 -1.208 . . . . 0.0 110.081 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.845 HG23 ' CG2' ' A' ' 55' ' ' ILE 0.26 3.1 pt -76.3 -120.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.285 -2.22 0 CA-C-O 122.648 1.213 . . . . 0.0 110.262 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 57' ' ' ILE . 26.2 t0 . . . . . 0 C--N 1.26 -3.288 0 CA-C-N 114.583 -1.19 . . . . 0.0 110.182 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.15 0.5 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 0.4 OUTLIER 174.84 176.16 0.17 Allowed 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.049 -1.032 . . . . 0.0 110.017 179.77 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.478 ' O ' ' HG2' ' A' ' 26' ' ' LYS . 38.9 tttt -178.12 42.6 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.3 -0.875 . . . . 0.0 110.024 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.493 ' O ' ' O ' ' A' ' 28' ' ' LYS . 21.4 pt-20 -45.17 -22.64 0.12 Allowed 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.272 -0.893 . . . . 0.0 110.58 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 27' ' ' GLU . 20.2 ptmt -53.09 -162.63 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.345 -0.847 . . . . 0.0 111.104 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 28' ' ' LYS . 2.2 ttpt -39.34 126.28 1.74 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.401 -0.812 . . . . 0.0 111.078 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.463 ' O ' ' O ' ' A' ' 31' ' ' GLY . 5.9 mttp -66.58 -174.44 0.3 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.313 -0.867 . . . . 0.0 110.364 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.463 ' O ' ' O ' ' A' ' 30' ' ' LYS . . . -54.11 -168.4 0.03 OUTLIER Glycine 0 N--CA 1.483 1.774 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.502 ' HG2' ' HB2' ' A' ' 34' ' ' LYS . 43.3 Cg_endo -67.47 -169.39 0.21 Allowed 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.108 1.583 . . . . 0.0 111.28 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -93.88 12.87 24.44 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 123.279 1.514 . . . . 0.0 110.088 -179.557 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.563 ' HB3' ' CB ' ' A' ' 38' ' ' TYR 0.26 0.1 OUTLIER -60.67 157.19 15.1 Favored 'General case' 0 C--N 1.265 -3.07 0 CA-C-N 113.957 -1.474 . . . . 0.0 110.641 179.473 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.672 ' HA ' ' CD1' ' A' ' 38' ' ' TYR . 0.2 OUTLIER -165.5 -27.04 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 O-C-N 120.928 -1.108 . . . . 0.0 111.797 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.4 OUTLIER -97.33 -70.85 0.7 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.915 -1.115 . . . . 0.0 109.774 179.488 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -63.55 -14.65 53.32 Favored 'General case' 0 C--N 1.284 -2.253 0 CA-C-O 122.005 0.907 . . . . 0.0 108.667 178.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.765 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -78.58 -19.79 51.99 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.266 -179.725 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.586 ' N ' ' CD1' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -45.62 -56.04 5.65 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.214 -0.929 . . . . 0.0 108.994 178.619 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.96 HD13 ' CD2' ' A' ' 43' ' ' PHE . 2.4 mm? -62.37 -24.83 67.58 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 121.844 0.831 . . . . 0.0 109.758 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 38' ' ' TYR . . . -55.22 -44.76 75.73 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.085 -1.009 . . . . 0.0 108.567 178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.433 ' O ' ' C ' ' A' ' 43' ' ' PHE . 0.1 OUTLIER -89.49 -17.78 27.99 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.382 0.61 . . . . 0.0 110.998 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.96 ' CD2' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -41.05 -44.31 2.39 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.419 -0.8 . . . . 0.0 110.335 -179.467 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.619 ' N ' ' CD ' ' A' ' 44' ' ' LYS . 12.0 mptt -73.0 14.37 0.29 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.043 -1.036 . . . . 0.0 113.151 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.482 ' O ' ' HG2' ' A' ' 49' ' ' LYS . . . -156.46 -99.24 0.16 Allowed Glycine 0 N--CA 1.489 2.225 0 C-N-CA 119.491 -1.337 . . . . 0.0 111.702 -179.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.521 ' HA ' ' CD ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -92.45 58.85 3.27 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.677 -0.896 . . . . 0.0 110.252 -178.575 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.526 ' O ' ' HB2' ' A' ' 51' ' ' LYS . . . -130.73 -67.35 0.1 OUTLIER Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.202 -1.959 . . . . 0.0 108.202 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -67.36 -44.19 87.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.901 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.521 ' CD ' ' HA ' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -41.51 -58.8 1.79 Allowed 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.269 -0.894 . . . . 0.0 113.214 -176.74 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.673 ' CD1' ' N ' ' A' ' 51' ' ' LYS . 18.3 p90 -89.3 -37.8 14.66 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.291 -1.505 . . . . 0.0 112.327 -178.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.673 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -49.17 -53.53 20.7 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 120.225 -1.547 . . . . 0.0 109.82 -179.831 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.476 ' O ' ' HB ' ' A' ' 55' ' ' ILE . . . -59.15 -54.08 51.08 Favored 'General case' 0 C--N 1.283 -2.285 0 CA-C-O 122.463 1.125 . . . . 0.0 110.315 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.52 -53.34 56.18 Favored 'General case' 0 C--N 1.284 -2.273 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.397 -178.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 50' ' ' TYR . 40.1 mt -51.46 -26.58 8.41 Favored 'General case' 0 C--N 1.308 -1.23 0 O-C-N 120.823 -1.173 . . . . 0.0 110.795 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.777 HG22 HG23 ' A' ' 57' ' ' ILE 0.334 0.3 OUTLIER -74.93 -54.88 13.34 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 CA-C-O 121.82 0.819 . . . . 0.0 109.958 179.81 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.692 ' N ' HG22 ' A' ' 55' ' ' ILE . . . 111.51 48.97 0.67 Allowed Glycine 0 C--N 1.299 -1.491 0 N-CA-C 110.048 -1.221 . . . . 0.0 110.048 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.777 HG23 HG22 ' A' ' 55' ' ' ILE 0.266 2.7 pt -76.5 -121.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.168 0 CA-C-O 122.768 1.271 . . . . 0.0 109.899 179.7 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 C--N 1.261 -3.274 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.501 179.946 . . . . . . . . 0 0 . 1 stop_ save_